SMILES
stringlengths 6
120
| Deep SMILES
stringlengths 6
124
| SELFIES
stringlengths 18
409
| SAFE
stringlengths 9
126
|
|---|---|---|---|
CN1CCCC[C@H](C(=O)N[C@@H]2C[C@H]2NC(=O)c2cccc(C3(C#N)CC3)c2)C1=O
|
CNCCCC[C@H]C=O)N[C@@H]C[C@H]3NC=O)cccccCC#N))CC3)))c6)))))))))))))C7=O
|
[C][N][C][C][C][C][C@H1][Branch2][Ring2][Ring1][C][=Branch1][C][=O][N][C@@H1][C][C@H1][Ring1][Ring1][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][#Branch2][C][Branch1][Ring1][C][#N][C][C][Ring1][Branch1][=C][Ring1][O][C][Ring2][Ring1][O][=O]
|
CN1CCCCC8C1=O.c19cccc%10c1.C1%10(C#N)CC1.C16CC17.C48=O.C59=O.N46.N57
|
CCOC(=O)CCCCCCS(=O)(=O)N[C@@H](C(=O)OC)c1ccc(OC)c(Cl)c1
|
CCOC=O)CCCCCCS=O)=O)N[C@@H]C=O)OC)))ccccOC))cCl)c6
|
[C][C][O][C][=Branch1][C][=O][C][C][C][C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][N][C@@H1][Branch1][#Branch1][C][=Branch1][C][=O][O][C][C][=C][C][=C][Branch1][Ring1][O][C][C][Branch1][C][Cl][=C][Ring1][=Branch2]
|
C2(=O)CCCCCCS7(=O)=O.c18ccc5c(Cl)c1.C68C3=O.CC4.O24.N67.O3C.O5C
|
Cc1nc[nH]c1C(=O)N(C)[C@@H]1CN(C(=O)CCc2ccccc2C(N)=O)C[C@@H]1F
|
Ccnc[nH]c5C=O)NC)[C@@H]CNC=O)CCcccccc6CN)=O)))))))))))C[C@@H]5F
|
[C][C][N][=C][NH1][C][=Ring1][Branch1][C][=Branch1][C][=O][N][Branch1][C][C][C@@H1][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][N][=O][C][C@@H1][Ring2][Ring1][C][F]
|
C15CN4CC1F.c18ccccc17.Cc1nc[nH]c16.C4(=O)CC8.C36=O.N35C.C7(N)=O
|
C[C@H](CN(C)C(=O)c1cc(-c2cccc(Cl)c2)on1)NC(=O)c1c(Cl)cnn1C
|
C[C@H]CNC)C=O)ccc-cccccCl)c6))))))on5))))))))NC=O)ccCl)cnn5C
|
[C][C@H1][Branch2][Ring1][=C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][=C][Branch1][N][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][O][N][=Ring1][N][N][C][=Branch1][C][=O][C][=C][Branch1][C][Cl][C][=N][N][Ring1][=Branch1][C]
|
c19cccc(Cl)c1.c18c(Cl)cnn1C.c17cc9on1.CC5C6.N36C.C37=O.C48=O.N45
|
CN1CCCC[C@H]1CC(=O)NCC[C@H]1CCCN1C(=O)c1csc(Cl)c1Cl
|
CNCCCC[C@H]6CC=O)NCC[C@H]CCCN5C=O)ccscCl)c5Cl
|
[C][N][C][C][C][C][C@H1][Ring1][=Branch1][C][C][=Branch1][C][=O][N][C][C][C@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][=C][S][C][Branch1][C][Cl][=C][Ring1][=Branch1][Cl]
|
CN1CCCCC16.c15csc(Cl)c1Cl.C17CCCN13.C6C2=O.C4C7.C35=O.N24
|
CSc1nccc(N2[C@H]3CN(C(=O)c4c(Br)cccc4Br)C[C@H]32)n1
|
CScncccN[C@H]CNC=O)ccBr)cccc6Br))))))))C[C@H]56))))))n6
|
[C][S][C][=N][C][=C][C][Branch2][Ring1][=N][N][C@H1][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][Branch1][C][Br][C][=C][C][=C][Ring1][#Branch1][Br][C][C@H1][Ring1][#C][Ring1][S][=N][Ring2][Ring1][=Branch1]
|
c17c(Br)cccc1Br.c18nccc6n1.N16C2CN5CC21.C57=O.CS8
|
C#CCN(C(=O)COC)C1CCN(C(=O)c2cc3oc(C)c(C)c3[nH]2)CC1
|
C#CCNC=O)COC))))CCCNC=O)cccocC)cC)c5[nH]8)))))))))CC6
|
[C][#C][C][N][Branch1][Branch2][C][=Branch1][C][=O][C][O][C][C][C][C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C][=C][C][O][C][Branch1][C][C][=C][Branch1][C][C][C][=Ring1][#Branch1][NH1][Ring1][#Branch2][C][C][Ring2][Ring1][C]
|
c19cc2oc(C)c(C)c2[nH]1.C18CCN5CC1.C4(=O)C6.C#CC7.N478.C59=O.O6C
|
COC(=O)C(C)(C)C(=O)NC[C@H]1CCN1C(=O)c1noc2c1CC(F)(F)CC2
|
COC=O)CC)C)C=O)NC[C@H]CCN4C=O)cnocc5CCF)F)CC6
|
[C][O][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C@H1][C][C][N][Ring1][Ring2][C][=Branch1][C][=O][C][=N][O][C][=C][Ring1][Branch1][C][C][Branch1][C][F][Branch1][C][F][C][C][Ring1][Branch2]
|
c17noc2c1CC(F)(F)CC2.C3(=O)C(C)(C)C4=O.C18CCN15.C57=O.CO3.N46.C68
|
O=C1CC[C@H](CCC(=O)N2CCC(NC(=O)c3sc4sccc4c3Cl)CC2)N1
|
O=CCC[C@H]CCC=O)NCCCNC=O)cscsccc5c8Cl)))))))))))CC6)))))))))N5
|
[O][=C][C][C][C@H1][Branch2][Ring2][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][S][C][S][C][=C][C][=Ring1][Branch1][C][=Ring1][Branch2][Cl][C][C][Ring2][Ring1][C][N][Ring2][Ring1][O]
|
c18sc2sccc2c1Cl.N15CCC7CC1.O=C1CCC9N1.C9CC5=O.C68=O.N67
|
CC[C@@H](CO)C(=O)NCCCOC1CCN(C(=O)[C@@H](O)C2CCCCC2)CC1
|
CC[C@@H]CO))C=O)NCCCOCCCNC=O)[C@@H]O)CCCCCC6))))))))CC6
|
[C][C][C@@H1][Branch1][Ring1][C][O][C][=Branch1][C][=O][N][C][C][C][O][C][C][C][N][Branch1][P][C][=Branch1][C][=O][C@@H1][Branch1][C][O][C][C][C][C][C][C][Ring1][=Branch1][C][C][Ring1][S]
|
CCC(CO)C3=O.C16CCN4CC1.C18CCCCC1.C4(=O)C8O.C7CC5.N37.O56
|
CC[C@@H](C)c1nccc(N(CC)CC2CCN(C(=O)[C@]3(C)CCCCO3)CC2)n1
|
CC[C@@H]C)cncccNCC))CCCCNC=O)[C@]C)CCCCO6)))))))CC6))))))))n6
|
[C][C][C@@H1][Branch1][C][C][C][=N][C][=C][C][Branch2][Ring1][S][N][Branch1][Ring1][C][C][C][C][C][C][N][Branch1][S][C][=Branch1][C][=O][C@][Branch1][C][C][C][C][C][C][O][Ring1][#Branch1][C][C][Ring1][#C][=N][Ring2][Ring1][=Branch2]
|
c19nccc7n1.C1%10CCN4CC1.C18(C)CCCCO1.CCC9C.N567.C48=O.C5C.C6%10
|
C[C@H](CC(=O)N[C@@H]1CN(C(=O)C[C@@H]2COC(=O)C2)[C@H]2CCCC[C@H]12)c1ccco1
|
C[C@H]CC=O)N[C@@H]CNC=O)C[C@@H]COC=O)C5)))))))[C@H]CCCC[C@H]96))))))))))))cccco5
|
[C][C@H1][Branch2][Ring2][=Branch1][C][C][=Branch1][C][=O][N][C@@H1][C][N][Branch1][S][C][=Branch1][C][=O][C][C@@H1][C][O][C][=Branch1][C][=O][C][Ring1][=Branch1][C@H1][C][C][C][C][C@H1][Ring2][Ring1][C][Ring1][=Branch1][C][=C][C][=C][O][Ring1][Branch1]
|
C15CN4C2CCCCC12.CC6CC3=O.C17COC(=O)C1.c16ccco1.C4(=O)C7.N35
|
C[C@@H]1CCC=C1C(=O)NCc1occc1C(=O)NC[C@@H]1CCCOCC1
|
C[C@@H]CCC=C5C=O)NCcoccc5C=O)NC[C@@H]CCCOCC7
|
[C][C@@H1][C][C][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][O][C][=C][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][C][C][O][C][C][Ring1][#Branch1]
|
CC1CCC=C1C2=O.C18CCCOCC1.c17occc16.C36=O.N24.C47.N35.C58
|
C=C1CC[C@H]1C(=O)N1CCCC[C@H]1CCN=c1[nH]cnc(Cl)c1F
|
C=CCC[C@H]4C=O)NCCCC[C@H]6CCN=c[nH]cncCl)c6F
|
[C][=C][C][C][C@H1][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][C][C][C@H1][Ring1][=Branch1][C][C][N][=C][NH1][C][=N][C][Branch1][C][Cl][=C][Ring1][#Branch1][F]
|
C4CN=c1[nH]cnc(Cl)c1F.N12CCCCC14.C=C1CCC13.C23=O
|
Cc1nc(-c2ccsc2)sc1C(=O)NC[C@@H](NC(=O)c1n[nH]c(C)c1C)C(C)C
|
Ccnc-cccsc5)))))sc5C=O)NC[C@@H]NC=O)cn[nH]cC)c5C))))))))CC)C
|
[C][C][N][=C][Branch1][Branch2][C][C][=C][S][C][=Ring1][Branch1][S][C][=Ring1][#Branch2][C][=Branch1][C][=O][N][C][C@@H1][Branch1][P][N][C][=Branch1][C][=O][C][=N][NH1][C][Branch1][C][C][=C][Ring1][=Branch1][C][C][Branch1][C][C][C]
|
Cc1nc9sc17.c18n[nH]c(C)c1C.C5C6C(C)C.c19ccsc1.C37=O.C48=O.N35.N46
|
CCN1CCN(c2cc(N3CCC(C)=C(Br)C3)nc(COC)n2)CC1=O
|
CCNCCNcccNCCCC)=CBr)C6))))))ncCOC)))n6))))))CC6=O
|
[C][C][N][C][C][N][Branch2][Ring1][=C][C][=C][C][Branch1][#C][N][C][C][C][Branch1][C][C][=C][Branch1][C][Br][C][Ring1][Branch2][=N][C][Branch1][Ring2][C][O][C][=N][Ring1][P][C][C][Ring2][Ring1][#Branch1][=O]
|
N17CCN5CC1=O.c15cc6nc8n1.N16CCC(C)=C(Br)C1.CC7.C48.O4C
|
CCC1(C)CC(C(=O)N2[C@H]3CC[C@@H]2C[C@@H](NC(=O)C=Cc2cn(C)nn2)C3)C1
|
CCCC)CCC=O)N[C@H]CC[C@@H]5C[C@@H]NC=O)C=CccnC)nn5)))))))))C7)))))))))C4
|
[C][C][C][Branch1][C][C][C][C][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C@H1][C][C][C@@H1][Ring1][Branch1][C][C@@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][=C][C][=C][N][Branch1][C][C][N][=N][Ring1][=Branch1][C][Ring2][Ring1][C][C][Ring2][Ring1][#Branch2]
|
N14C2CCC1CC6C2.C=8c1cn(C)nn1.C19(C)CC7C1.C5(=O)C=8.C47=O.CC9.N56
|
CCC[C@@H](NC(C)=O)C(=O)N[C@@H]1CC[C@H](NC(=O)c2ccccc2CO)C1
|
CCC[C@@H]NCC)=O)))C=O)N[C@@H]CC[C@H]NC=O)cccccc6CO))))))))))C5
|
[C][C][C][C@@H1][Branch1][#Branch1][N][C][Branch1][C][C][=O][C][=Branch1][C][=O][N][C@@H1][C][C][C@H1][Branch1][S][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][O][C][Ring1][S]
|
CCCC6C4=O.c19ccccc1%10.C17CCC8C1.C3(C)=O.C59=O.N36.N47.N58.C%10O
|
O=C(Cc1ccsc1Cl)N[C@@H](CNC(=O)C1CC=CC1)C12CCC(CC1)C2
|
O=CCcccsc5Cl)))))))N[C@@H]CNC=O)CCC=CC5))))))))CCCCCC6))C5
|
[O][=C][Branch1][#Branch2][C][C][C][=C][S][C][=Ring1][Branch1][Cl][N][C@@H1][Branch1][=C][C][N][C][=Branch1][C][=O][C][C][C][=C][C][Ring1][Branch1][C][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][Ring1][#Branch1]
|
C128CCC(CC1)C2.c19ccsc1Cl.C17CC=CC1.O=C3C9.C58C6.C47=O.N35.N46
|
COC1=CC=C(C)C=C1C(=O)NCC1(C)CC(NC(=O)CCC2(C#N)CCC2)C1
|
COC=CC=CC)C=C6C=O)NCCC)CCNC=O)CCCC#N))CCC4))))))))C4
|
[C][O][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][Branch1][C][C][C][C][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][C][C][Branch1][Ring1][C][#N][C][C][C][Ring1][=Branch1][C][Ring1][S]
|
c15ccc(C)cc18.C19(C)CC7C1.C1%10(C#N)CCC1.C4(=O)CC%10.C38=O.CO5.N36.C69.N47
|
O=C1CC2(CCN(C(=O)c3[nH]c4ccccc4c3-c3cscn3)CC2)N1
|
O=CCCCCNC=O)c[nH]cccccc6c9-ccscn5)))))))))))))))CC6)))))N4
|
[O][=C][C][C][Branch2][Ring2][Ring2][C][C][N][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][C][NH1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Ring1][=Branch2][C][=C][S][C][=N][Ring1][Branch1][C][C][Ring2][Ring1][=Branch1][N][Ring2][Ring1][=Branch2]
|
O=C1CC2(CCN5CC2)N1.c16[nH]c2ccccc2c17.c17cscn1.C56=O
|
O=C(CC[C@H]1CCCO1)NCC1(NC(=O)c2cccc3ccnn23)CCOCC1
|
O=CCC[C@H]CCCO5)))))))NCCNC=O)cccccccnn95)))))))))))CCOCC6
|
[O][=C][Branch1][#Branch2][C][C][C@H1][C][C][C][O][Ring1][Branch1][N][C][C][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][C][=N][N][Ring1][=Branch2][Ring1][Branch1][C][C][O][C][C][Ring2][Ring1][C]
|
c18cccc2ccnn12.C17%10CCOCC1.O=C4CC9.C19CCCO1.C58=O.N46.C6%10.N57
|
C#CCCC(=O)N[C@H]1CCN(C(=O)c2cc(F)cc(Cl)c2Cl)C[C@@H]1F
|
C#CCCC=O)N[C@H]CCNC=O)cccF)ccCl)c6Cl))))))))C[C@@H]6F
|
[C][#C][C][C][C][=Branch1][C][=O][N][C@H1][C][C][N][Branch2][Ring1][Ring2][C][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][C][Branch1][C][Cl][=C][Ring1][Branch2][Cl][C][C@@H1][Ring1][P][F]
|
c16cc(F)cc(Cl)c1Cl.C15CCN4CC1F.C#CCCC3=O.C46=O.N35
|
CCn1nc(C)c2cc(C(=O)N3CC(CNC(=O)[C@@H](O)CSC)C3)sc21
|
CCnncC)cccC=O)NCCCNC=O)[C@@H]O)CSC)))))))C4)))))sc58
|
[C][C][N][N][=C][Branch1][C][C][C][C][=C][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][N][C][C][Branch1][=C][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][O][C][S][C][C][Ring1][=N][S][C][=Ring2][Ring1][Ring2][Ring2][Ring1][Branch2]
|
n19nc(C)c2cc8sc21.C5(=O)C(O)C7.N14CC%10C1.C48=O.CC9.C6%10.N56.S7C
|
CC[C@@H]1CN(C(=O)[C@@H](C)c2ccsc2)CCN1C(=O)C(F)=C1CCCC1
|
CC[C@@H]CNC=O)[C@@H]C)cccsc5)))))))CCN6C=O)CF)=CCCCC5
|
[C][C][C@@H1][C][N][Branch1][S][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][C][=C][S][C][=Ring1][Branch1][C][C][N][Ring1][#C][C][=Branch1][C][=O][C][Branch1][C][F][=C][C][C][C][C][Ring1][Branch1]
|
C16CN3CCN14.C3(=O)C7C.c17ccsc1.C4(=O)C=5F.C1=5CCCC1.CC6
|
COC(=O)c1ccc2sc(N3CCS(=O)(=O)C4(CCCCC4)C3)nc2c1
|
COC=O)ccccscNCCS=O)=O)CCCCCC6)))))C6))))))nc5c9
|
[C][O][C][=Branch1][C][=O][C][=C][C][=C][S][C][Branch2][Ring1][Branch2][N][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][Branch1][Branch2][C][C][C][C][C][Ring1][=Branch1][C][Ring1][=N][=N][C][Ring2][Ring1][C][=C][Ring2][Ring1][=Branch1]
|
N16CCS(=O)(=O)C2(CCCCC2)C1.c17ccc2sc6nc2c1.C57=O.CO5
|
C[C@@H]1OC2(CNC(=O)C[C@@H]3CCOCC3(C)C)CC1(NC(=O)[C@@H]1CSCCS1)C2
|
C[C@@H]OCCNC=O)C[C@@H]CCOCC6C)C)))))))))))CC5NC=O)[C@@H]CSCCS6))))))))C4
|
[C][C@@H1][O][C][Branch2][Ring1][Ring2][C][N][C][=Branch1][C][=O][C][C@@H1][C][C][O][C][C][Ring1][=Branch1][Branch1][C][C][C][C][C][Ring2][Ring1][C][Branch1][=C][N][C][=Branch1][C][=O][C@@H1][C][S][C][C][S][Ring1][=Branch1][C][Ring2][Ring1][#Branch2]
|
CC1OC29CC17C2.C1%10CCOCC1(C)C.C18CSCCS1.C4(=O)C%10.C58=O.C69.N46.N57
|
C[C@@H]1COC[C@H](CC(=O)N2[C@H]3CC=C(C(=O)N4CCC[C@@H](N=[N+]=[N-])C4)[C@H]2CC3)O1
|
C[C@@H]COC[C@H]CC=O)N[C@H]CC=CC=O)NCCC[C@@H]N=[N+]=[N-])))C6)))))))[C@H]6CC7))))))))))O6
|
[C][C@@H1][C][O][C][C@H1][Branch2][Ring2][#Branch1][C][C][=Branch1][C][=O][N][C@H1][C][C][=C][Branch2][Ring1][C][C][=Branch1][C][=O][N][C][C][C][C@@H1][Branch1][Ring2][N][=N+1][=N-1][C][Ring1][=Branch2][C@H1][Ring1][P][C][C][Ring2][Ring1][C][O][Ring2][Ring1][N]
|
N15C2CC=C(C6=O)C1CC2.N16CCCC(N=[N+]=[N-])C1.CC1COCC7O1.C7C5=O
|
COC[C@H](OC)C(=O)N1CCC[C@](C)(CNC(=O)c2ccc3oc(C)nc3c2)C1
|
COC[C@H]OC))C=O)NCCC[C@]C)CNC=O)ccccocC)nc5c9))))))))))))C6
|
[C][O][C][C@H1][Branch1][Ring1][O][C][C][=Branch1][C][=O][N][C][C][C][C@][Branch1][C][C][Branch2][Ring1][#Branch1][C][N][C][=Branch1][C][=O][C][=C][C][=C][O][C][Branch1][C][C][=N][C][Ring1][=Branch1][=C][Ring1][#Branch2][C][Ring2][Ring1][Branch1]
|
c19ccc2oc(C)nc2c1.N14CCCC%10(C)C1.C6C7C4=O.C59=O.CO6.O7C.C8%10.N58
|
COCCN(C)C1CN(C(=O)[C@@H]2CCCCCN2C(=O)c2cc[nH]c(=N)n2)C1
|
COCCNC)CCNC=O)[C@@H]CCCCCN7C=O)ccc[nH]c=N)n6)))))))))))))))C4
|
[C][O][C][C][N][Branch1][C][C][C][C][N][Branch2][Ring1][=N][C][=Branch1][C][=O][C@@H1][C][C][C][C][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C][C][=C][NH1][C][=Branch1][C][=N][N][=Ring1][#Branch1][C][Ring2][Ring1][=Branch1]
|
C18CCCCCN14.c19cc[nH]c(=N)n1.C17CN3C1.C5C6.N67C.C38=O.C49=O.CO5
|
Cc1cc(C)n(CCCN2CCOC[C@@H](C(=O)N3CCC[C@H](C)C3)C2)n1
|
CcccC)nCCCNCCOC[C@@H]C=O)NCCC[C@H]C)C6)))))))C7))))))))))n5
|
[C][C][C][=C][Branch1][C][C][N][Branch2][Ring1][=C][C][C][C][N][C][C][O][C][C@@H1][Branch1][S][C][=Branch1][C][=O][N][C][C][C][C@H1][Branch1][C][C][C][Ring1][#Branch1][C][Ring1][S][N][=Ring2][Ring1][=Branch2]
|
N15CCOCC6C1.Cc1cc(C)n7n1.N14CCCC(C)C1.C7CC5.C46=O
|
CC(C)Oc1ccccc1[C@@H](C)NC(=O)N[C@@H]1CCC[C@H]2OCC[C@@H]12
|
CCC)Occcccc6[C@@H]C)NC=O)N[C@@H]CCC[C@H]OCC[C@@H]95
|
[C][C][Branch1][C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C@@H1][Branch1][C][C][N][C][=Branch1][C][=O][N][C@@H1][C][C][C][C@H1][O][C][C][C@@H1][Ring1][=Branch2][Ring1][Branch1]
|
C18CCCC2OCCC12.c16ccccc19.CC5C.C79C.C34=O.O56.N37.N48
|
CSc1cc(NC(C)(C)CNC(=O)c2scnc2C(F)F)nc(SC)n1
|
CScccNCC)C)CNC=O)cscnc5CF)F))))))))))))ncSC))n6
|
[C][S][C][=C][C][Branch2][Ring1][O][N][C][Branch1][C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C][S][C][=N][C][=Ring1][Branch1][C][Branch1][C][F][F][=N][C][Branch1][Ring1][S][C][=N][Ring2][Ring1][Branch2]
|
c19cc6nc%10n1.c17scnc18.C4(C)(C)C5.C37=O.C8(F)F.CS9.N46.N35.S%10C
|
CC[C@H](CNC(=O)[C@]1(NC(=O)[C@H]2Cc3nccn3C2)C[C@@H](O)C1)C(C)C
|
CC[C@H]CNC=O)[C@]NC=O)[C@H]Ccnccn5C8))))))))))C[C@@H]O)C4)))))))CC)C
|
[C][C][C@H1][Branch2][Ring2][Ring2][C][N][C][=Branch1][C][=O][C@][Branch2][Ring1][C][N][C][=Branch1][C][=O][C@H1][C][C][=N][C][=C][N][Ring1][Branch1][C][Ring1][Branch2][C][C@@H1][Branch1][C][O][C][Ring1][S][C][Branch1][C][C][C]
|
C19Cc2nccn2C1.CCC(C6)C(C)C.C178CC(O)C1.C48=O.C59=O.N46.N57
|
Cc1nccnc1C(=O)NC/C=C/C(=O)N1CC(N(C)C)C1
|
Ccnccnc6C=O)NC/C=C/C=O)NCCNC)C))C4
|
[C][C][=N][C][=C][N][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][/C][=C][/C][=Branch1][C][=O][N][C][C][Branch1][=Branch1][N][Branch1][C][C][C][C][Ring1][#Branch1]
|
Cc1nccnc16.N13CC5C1.C=7C3=O.C26=O.C4C=7.N5(C)C.N24
|
Cc1cccc(-c2nc(=N[C@H](C)CNC(=O)c3cc4n(n3)CCC[C@H]4O)s[nH]2)c1
|
Cccccc-cnc=N[C@H]C)CNC=O)cccnn5)CCC[C@H]6O))))))))))))))s[nH]5)))))c6
|
[C][C][=C][C][=C][C][Branch2][Ring2][#Branch1][C][=N][C][=Branch2][Ring1][N][=N][C@H1][Branch1][C][C][C][N][C][=Branch1][C][=O][C][C][=C][N][Branch1][Ring2][N][=Ring1][Branch1][C][C][C][C@H1][Ring1][#Branch1][O][S][NH1][Ring2][Ring1][=Branch1][=C][Ring2][Ring1][N]
|
c18nc(=NC(C)C6)s[nH]1.c17cc2n(n1)CCCC2O.Cc1cccc8c1.C57=O.N56
|
C=CCCC[C@@H](NC(=O)CC[C@@H](CC)OC)C(=O)Nc1ccc2c(c1)OCO2
|
C=CCCC[C@@H]NC=O)CC[C@@H]CC))OC)))))))C=O)Ncccccc6)OCO5
|
[C][=C][C][C][C][C@@H1][Branch1][#C][N][C][=Branch1][C][=O][C][C][C@@H1][Branch1][Ring1][C][C][O][C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][O][Ring1][=Branch1]
|
C=CCCCC6C4=O.c17ccc2c(c1)OCO2.C3(=O)CCC5CC.N36.O5C.N47
|
COC[C@@H]1CCN(C(=O)[C@H]2CCCN(Cc3cccc4nonc34)CC2)C1
|
COC[C@@H]CCNC=O)[C@H]CCCNCcccccnonc95))))))))))CC7))))))))C5
|
[C][O][C][C@@H1][C][C][N][Branch2][Ring1][=C][C][=Branch1][C][=O][C@H1][C][C][C][N][Branch1][#C][C][C][=C][C][=C][C][=N][O][N][=C][Ring1][=Branch2][Ring1][Branch1][C][C][Ring1][P][C][Ring2][Ring1][Branch2]
|
c1%10cccc2nonc12.C18CCCN7CC1.C19CCN5C1.C58=O.CO6.C69.C7%10
|
COC[C@@H](C)NC(=O)[C@@H]1C[C@@]12CCN(C(=O)c1cccc(N3CCOCC3)c1)C2
|
COC[C@@H]C)NC=O)[C@@H]C[C@@]3CCNC=O)cccccNCCOCC6))))))c6)))))))C5
|
[C][O][C][C@@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@@H1][C][C@@][Ring1][Ring1][C][C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][=Branch2][N][C][C][O][C][C][Ring1][=Branch1][=C][Ring1][N][C][Ring2][Ring1][Ring1]
|
C19CC12CCN5C2.c1%10cccc8c1.N18CCOCC1.C6C7C.C49=O.C5%10=O.CO6.N47
|
CC1CC(C)(N[C@H](c2ccc3c(Br)cccc3c2)c2nnnn2CCC2CC2)C1
|
CCCCC)N[C@H]cccccBr)cccc6c%10))))))))))cnnnn5CCCCC3))))))))))))C4
|
[C][C][C][C][Branch1][C][C][Branch2][Ring2][Branch1][N][C@H1][Branch2][Ring1][C][C][=C][C][=C][C][Branch1][C][Br][=C][C][=C][C][Ring1][#Branch1][=C][Ring1][O][C][=N][N][=N][N][Ring1][Branch1][C][C][C][C][C][Ring1][Ring1][C][Ring2][Ring1][N]
|
c19ccc2c(Br)cccc2c1.CC1CC4(C)C1.c17nnnn16.C579.C6C8.C18CC1.N45
|
O=C(CC[C@@H]1CC1(F)F)N1CC2(CCN(C(=O)c3cn(C(F)F)cn3)CC2)C1
|
O=CCC[C@@H]CC3F)F))))))NCCCCNC=O)ccnCF)F))cn5))))))CC6)))))C4
|
[O][=C][Branch1][N][C][C][C@@H1][C][C][Ring1][Ring1][Branch1][C][F][F][N][C][C][Branch2][Ring1][=N][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][=C][N][Branch1][=Branch1][C][Branch1][C][F][F][C][=N][Ring1][Branch2][C][C][Ring1][S][C][Ring2][Ring1][Ring1]
|
N14CC2(CCN5CC2)C1.c16cn7cn1.O=C4CC8.C18CC1(F)F.C56=O.C7(F)F
|
Cn1cnnc1SCC(=O)N[C@H]1CO[C@H]2CN(C(=O)CC[C@@H]3CCC(=O)N3)C[C@@H]12
|
Cncnnc5SCC=O)N[C@H]CO[C@H]CNC=O)CC[C@@H]CCC=O)N5))))))))C[C@@H]85
|
[C][N][C][=N][N][=C][Ring1][Branch1][S][C][C][=Branch1][C][=O][N][C@H1][C][O][C@H1][C][N][Branch1][P][C][=Branch1][C][=O][C][C][C@@H1][C][C][C][=Branch1][C][=O][N][Ring1][=Branch1][C][C@@H1][Ring2][Ring1][C][Ring1][#C]
|
C17COC2CN5CC12.Cn1cnnc19.C18CCC(=O)N1.C5(=O)CC8.C6C4=O.S69.N47
|
COc1ccc(OC)c(C(=O)NC[C@]23C[C@H]2CN(C(=O)[C@H]2COCCO2)C3)n1
|
COccccOC))cC=O)NC[C@]C[C@H]3CNC=O)[C@H]COCCO6)))))))C6)))))))))n6
|
[C][O][C][=C][C][=C][Branch1][Ring1][O][C][C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C@][C][C@H1][Ring1][Ring1][C][N][Branch1][=N][C][=Branch1][C][=O][C@H1][C][O][C][C][O][Ring1][=Branch1][C][Ring1][=C][=N][Ring2][Ring1][#Branch2]
|
c16ccc7c%10n1.C12%11CC1CN5C2.C19COCCO1.C4%10=O.C59=O.CO6.O7C.N48.C8%11
|
C=C[C@@H]1CN(C(=O)[C@@]2(CO)CCN(C(=O)CC3(OCC)CCC3)C2)CCO1
|
C=C[C@@H]CNC=O)[C@@]CO))CCNC=O)CCOCC)))CCC4))))))C5))))))CCO6
|
[C][=C][C@@H1][C][N][Branch2][Ring2][C][C][=Branch1][C][=O][C@@][Branch1][Ring1][C][O][C][C][N][Branch1][P][C][=Branch1][C][=O][C][C][Branch1][Ring2][O][C][C][C][C][C][Ring1][#Branch1][C][Ring1][P][C][C][O][Ring2][Ring1][=Branch2]
|
C=CC1CN4CCO1.C189CCN5C1.C16%10CCC1.C5(=O)C%10.C48=O.C9O.O67.C7C
|
CC(C)Cc1ccc(NC(=O)N2C[C@@H]3CC[C@]3(OCC(F)(F)F)C2)cc1
|
CCC)CccccNC=O)NC[C@@H]CC[C@]4OCCF)F)F))))C7)))))))))cc6
|
[C][C][Branch1][C][C][C][C][=C][C][=C][Branch2][Ring1][=N][N][C][=Branch1][C][=O][N][C][C@@H1][C][C][C@][Ring1][Ring2][Branch1][O][O][C][C][Branch1][C][F][Branch1][C][F][F][C][Ring1][=N][C][=C][Ring2][Ring1][=Branch1]
|
N15CC2CCC27C1.c19ccc8cc1.C6C(F)(F)F.CC(C)C9.C45=O.N48.O67
|
CC(C)(C)OC(=O)NCc1ccc(CN(C=O)CCC(F)(F)C(F)F)s1
|
CCC)C)OC=O)NCccccCNC=O))CCCF)F)CF)F)))))))s5
|
[C][C][Branch1][C][C][Branch1][C][C][O][C][=Branch1][C][=O][N][C][C][=C][C][=C][Branch2][Ring1][Branch1][C][N][Branch1][Ring1][C][=O][C][C][C][Branch1][C][F][Branch1][C][F][C][Branch1][C][F][F][S][Ring1][P]
|
C7CC(F)(F)C(F)F.c18ccc9s1.CC4(C)C.N67C=O.C23=O.O24.N35.C58.C69
|
Cc1occc(=O)c1OCC(=O)N(CCO)CCCNC(=O)c1ccnc(O)c1
|
Ccoccc=O)c6OCC=O)NCCO)))CCCNC=O)cccncO)c6
|
[C][C][O][C][=C][C][=Branch1][C][=O][C][=Ring1][#Branch1][O][C][C][=Branch1][C][=O][N][Branch1][Ring2][C][C][O][C][C][C][N][C][=Branch1][C][=O][C][=C][C][=N][C][Branch1][C][O][=C][Ring1][#Branch1]
|
Cc1occc(=O)c15.c19ccnc(O)c1.C4C2=O.C7CC8.N267.C6CO.C39=O.O45.N38
|
CCN(C(=O)[C@@H](F)CC(C)(C)C)[C@@H]1CCCN(C(=O)CCNC(C)=O)C1
|
CCNC=O)[C@@H]F)CCC)C)C)))))[C@@H]CCCNC=O)CCNCC)=O))))))C6
|
[C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C@@H1][Branch1][C][F][C][C][Branch1][C][C][Branch1][C][C][C][C@@H1][C][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][C][N][C][Branch1][C][C][=O][C][Ring1][=C]
|
C2(=O)C(F)CC(C)(C)C.C17CCCN3C1.C3(=O)CC6.N257.C4(C)=O.CC5.N46
|
O=C(c1ccnn1CCF)N1C[C@H]2C[C@H]1CCN2C(=O)[C@H]1CCN1C1CCCC1
|
O=Ccccnn5CCF))))))))NC[C@H]C[C@H]5CCN6C=O)[C@H]CCN4CCCCC5
|
[O][=C][Branch1][O][C][=C][C][=N][N][Ring1][Branch1][C][C][F][N][C][C@H1][C][C@H1][Ring1][Branch1][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C@H1][C][C][N][Ring1][Ring2][C][C][C][C][C][Ring1][Branch1]
|
N13CC2CC1CCN24.c17ccnn18.C16CCN15.C15CCCC1.O=C37.C8CF.C46=O
|
C[C@H](Cc1ccc(F)cc1)C(=O)N1CCC[C@@H](NC(=O)CC2CS(=O)(=O)C2)[C@H]1C
|
C[C@H]CccccF)cc6)))))))C=O)NCCC[C@@H]NC=O)CCCS=O)=O)C4)))))))[C@H]6C
|
[C][C@H1][Branch1][=N][C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][C][C@@H1][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][Ring1][=Branch1][C@H1][Ring1][S][C]
|
N13CCCC5C1C.c17ccc(F)cc1.CC(C7)C3=O.C16CS(=O)(=O)C1.C4(=O)C6.N45
|
C[C@@H]1CC2(CO1)CC(NC(=O)C(=O)N[C@@H](CC1CCOCC1)c1ccccc1)C2
|
C[C@@H]CCCO5))CCNC=O)C=O)N[C@@H]CCCCOCC6)))))))cccccc6)))))))))))C4
|
[C][C@@H1][C][C][Branch1][Branch1][C][O][Ring1][Branch1][C][C][Branch2][Ring1][#C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C@@H1][Branch1][#Branch2][C][C][C][C][O][C][C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring2][Ring1][#Branch2]
|
CC1CC2(CO1)CC6C2.C17CCOCC1.c18ccccc1.C3(=O)C4=O.C58C7.N36.N45
|
COc1ccnc(C(=O)NC2CC(N(C)C(=O)c3ccc(C)c(CO)c3)C2)c1F
|
COcccncC=O)NCCCNC)C=O)ccccC)cCO))c6))))))))C4))))))c6F
|
[C][O][C][=C][C][=N][C][Branch2][Ring2][=Branch1][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][Branch2][N][Branch1][C][C][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][C][C][Branch1][Ring1][C][O][=C][Ring1][=Branch2][C][Ring1][P][=C][Ring2][Ring1][#Branch2][F]
|
c16ccnc9c1F.c1%10ccc(C)c%11c1.C17CC8C1.C49=O.N58C.C5%10=O.CO6.N47.C%11O
|
COc1c(C)ncnc1N1C[C@H]2C[C@@H](NC(=O)c3cocc3C)C[C@H]1C2
|
COccC)ncnc6NC[C@H]C[C@@H]NC=O)ccocc5C))))))))C[C@H]7C6
|
[C][O][C][=C][Branch1][C][C][N][=C][N][=C][Ring1][#Branch1][N][C][C@H1][C][C@@H1][Branch1][=C][N][C][=Branch1][C][=O][C][=C][O][C][=C][Ring1][Branch1][C][C][C@H1][Ring1][S][C][Ring1][#C]
|
N16CC2CC7CC1C2.c15c6ncnc1C.c18cocc1C.C48=O.CO5.N47
|
CN(C(=O)c1ncnc2c1c(Br)cn2C)C1CC(NC(=O)c2ccccc2)C1
|
CNC=O)cncncc6cBr)cn5C)))))))))))CCCNC=O)cccccc6))))))))C4
|
[C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][=N][C][=N][C][=C][Ring1][=Branch1][C][Branch1][C][Br][=C][N][Ring1][=Branch1][C][C][C][C][Branch1][=C][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][=N]
|
c17ncnc2c1c(Br)cn2C.c18ccccc1.C15CC6C1.CN35.C37=O.C48=O.N46
|
CC[C@]1(C(=O)N[C@H]2COC[C@H]2NC(=O)C2(Cl)CC2)CCNC1=O
|
CC[C@]C=O)N[C@H]COC[C@H]5NC=O)CCl)CC3))))))))))))CCNC5=O
|
[C][C][C@][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][N][C@H1][C][O][C][C@H1][Ring1][Branch1][N][C][=Branch1][C][=O][C][Branch1][C][Cl][C][C][Ring1][Ring2][C][C][N][C][Ring2][Ring1][Ring2][=O]
|
C179CCNC1=O.C15COCC16.C18(Cl)CC1.C37=O.C48=O.CC9.N35.N46
|
C=CCOCC(=O)N1C[C@@H](OC)C[C@H]1CCNC(=O)c1oc(C(C)C)nc1C
|
C=CCOCC=O)NC[C@@H]OC))C[C@H]5CCNC=O)cocCC)C))nc5C
|
[C][=C][C][O][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][Ring1][O][C][C][C@H1][Ring1][#Branch1][C][C][N][C][=Branch1][C][=O][C][O][C][Branch1][=Branch1][C][Branch1][C][C][C][=N][C][=Ring1][Branch2][C]
|
N12CC6CC19.c18oc%10nc1C.C5C2=O.C=CC4.C9C7.C38=O.C%10(C)C.O45.O6C.N37
|
CC[C@H](O)C(C)(C)C(=O)N[C@H](CCC(=O)N[C@H]1C[C@@H](OC)C1)C(C)C
|
CC[C@H]O)CC)C)C=O)N[C@H]CCC=O)N[C@H]C[C@@H]OC))C4))))))))CC)C
|
[C][C][C@H1][Branch1][C][O][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C@H1][Branch2][Ring1][C][C][C][C][=Branch1][C][=O][N][C@H1][C][C@@H1][Branch1][Ring1][O][C][C][Ring1][=Branch1][C][Branch1][C][C][C]
|
CCC(O)C(C)(C)C2=O.C5(CCC3=O)C(C)C.C16CC4C1.N25.N36.O4C
|
CCCOc1ccc(CCC(=O)N2CC(C[C@H](C)NC(=O)[C@@]3(C)C[C@@H]3C)C2)cc1
|
CCCOccccCCC=O)NCCC[C@H]C)NC=O)[C@@]C)C[C@@H]3C))))))))C4)))))))cc6
|
[C][C][C][O][C][=C][C][=C][Branch2][Ring2][Ring1][C][C][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][Ring2][C][C@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@@][Branch1][C][C][C][C@@H1][Ring1][Ring2][C][C][Ring1][#C][C][=C][Ring2][Ring1][=Branch2]
|
c17ccc%11cc1.C%11CC4=O.N14CC%10C1.C19(C)CC1C.C%10C8C.CCC6.C59=O.O67.N58
|
Cc1cnc([C@@H](C)NC(=O)[C@H](NC(=O)c2csc(Cl)n2)C2(C)CC2)nc1
|
Cccnc[C@@H]C)NC=O)[C@H]NC=O)ccscCl)n5)))))))CC)CC3)))))))nc6
|
[C][C][=C][N][=C][Branch2][Ring2][Ring2][C@@H1][Branch1][C][C][N][C][=Branch1][C][=O][C@H1][Branch1][S][N][C][=Branch1][C][=O][C][=C][S][C][Branch1][C][Cl][=N][Ring1][=Branch1][C][Branch1][C][C][C][C][Ring1][Ring2][N][=C][Ring2][Ring1][=Branch2]
|
Cc1cnc8nc1.c17csc(Cl)n1.C3(=O)C69.C19(C)CC1.C58C.C47=O.N35.N46
|
Cc1nn(-c2cc(N3CCCC[C@@H]3C(F)(F)CO)ncn2)c(C)c1Br
|
Ccnn-cccNCCCC[C@@H]6CF)F)CO)))))))))ncn6))))))cC)c5Br
|
[C][C][=N][N][Branch2][Ring1][=N][C][=C][C][Branch2][Ring1][C][N][C][C][C][C][C@@H1][Ring1][=Branch1][C][Branch1][C][F][Branch1][C][F][C][O][=N][C][=N][Ring1][P][C][Branch1][C][C][=C][Ring2][Ring1][#Branch1][Br]
|
Cc1nn6c(C)c1Br.c16cc4ncn1.N14CCCCC15.C5(F)(F)CO
|
C[C@@H](F)CCN(C)Cc1c(Cl)cccc1Br
|
C[C@@H]F)CCNC)CccCl)cccc6Br
|
[C][C@@H1][Branch1][C][F][C][C][N][Branch1][C][C][C][C][=C][Branch1][C][Cl][C][=C][C][=C][Ring1][#Branch1][Br]
|
c14c(Cl)cccc1Br.CC(F)CC2.N23C.C34
|
COc1cc(OCCN(C)C)ccc1NC(=O)NCCc1ccnc(C)n1
|
COcccOCCNC)C)))))ccc6NC=O)NCCcccncC)n6
|
[C][O][C][=C][C][Branch1][=Branch2][O][C][C][N][Branch1][C][C][C][=C][C][=C][Ring1][N][N][C][=Branch1][C][=O][N][C][C][C][=C][C][=N][C][Branch1][C][C][=N][Ring1][#Branch1]
|
c15cc6ccc19.c1%10ccnc(C)n1.C4C7.N7(C)C.C23=O.C8C%10.CO5.O46.N29.N38
|
CCC[C@@H](CCCNC(=O)c1cccnc1Cl)Nc1nc(C)cc(C(F)(F)F)n1
|
CCC[C@@H]CCCNC=O)ccccnc6Cl))))))))))))NcncC)ccCF)F)F))n6
|
[C][C][C][C@@H1][Branch2][Ring1][C][C][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][N][=C][Ring1][=Branch1][Cl][N][C][=N][C][Branch1][C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=N][Ring1][O]
|
CCCC3CCC4.c15nc7cc(C)n1.c16cccnc1Cl.C7(F)(F)F.C26=O.N24.N35
|
Cc1nc(CC(=O)N2CCN(C(=O)C=Cc3ccc(C(N)=O)cc3)CC2)co1
|
CcncCC=O)NCCNC=O)C=CccccCN)=O))cc6)))))))))CC6))))))))co5
|
[C][C][=N][C][Branch2][Ring2][#Branch1][C][C][=Branch1][C][=O][N][C][C][N][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Branch1][=Branch1][C][Branch1][C][N][=O][C][=C][Ring1][=Branch2][C][C][Ring2][Ring1][Ring1][=C][O][Ring2][Ring1][O]
|
C=7c1ccc6cc1.N14CCN5CC1.Cc1nc8co1.C8C4=O.C5(=O)C=7.C6(N)=O
|
O=C(CCOCCNC(=O)C12CCC(CO)(CC1)C2)N1CCC[C@H]2C[C@H]21
|
O=CCCOCCNC=O)CCCCCO))CC6))C5))))))))))))NCCC[C@H]C[C@H]37
|
[O][=C][Branch2][Ring1][N][C][C][O][C][C][N][C][=Branch1][C][=O][C][C][C][C][Branch1][Ring1][C][O][Branch1][Branch1][C][C][Ring1][Branch2][C][Ring1][=Branch2][N][C][C][C][C@H1][C][C@H1][Ring1][Ring1][Ring1][#Branch1]
|
C128CCC9(CC1)C2.N13CCCC2CC21.O=C3CC5.C6C7.C48=O.O56.N47.C9O
|
CCC(=O)N[C@@H](C)C(=O)N1C[C@@H](O)C[C@H]1C(=O)NO[C@H](C)CC
|
CCC=O)N[C@@H]C)C=O)NC[C@@H]O)C[C@H]5C=O)NO[C@H]C)CC
|
[C][C][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][O][C][C@H1][Ring1][=Branch1][C][=Branch1][C][=O][N][O][C@H1][Branch1][C][C][C][C]
|
N13CC(O)CC16.C5(C)C3=O.C6(=O)NO4.CCC2=O.C4(C)CC.N25
|
C=CCCC(F)(F)C(=O)NC[C@@H](O)CNC(=O)[C@H](O)CCC(F)(F)F
|
C=CCCCF)F)C=O)NC[C@@H]O)CNC=O)[C@H]O)CCCF)F)F
|
[C][=C][C][C][C][Branch1][C][F][Branch1][C][F][C][=Branch1][C][=O][N][C][C@@H1][Branch1][C][O][C][N][C][=Branch1][C][=O][C@H1][Branch1][C][O][C][C][C][Branch1][C][F][Branch1][C][F][F]
|
C2(=O)C(O)CCC(F)(F)F.C=CCCC(F)(F)C1=O.C3C(O)C4.N13.N24
|
CC(=O)Nc1sc(C)c(C)c1C(=O)NC[C@@H]1C=CCN1C(=O)c1scnc1C
|
CC=O)NcscC)cC)c5C=O)NC[C@@H]C=CCN5C=O)cscnc5C
|
[C][C][=Branch1][C][=O][N][C][S][C][Branch1][C][C][=C][Branch1][C][C][C][=Ring1][#Branch1][C][=Branch1][C][=O][N][C][C@@H1][C][=C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][S][C][=N][C][=Ring1][Branch1][C]
|
c16sc(C)c(C)c18.C19C=CCN14.c17scnc1C.CC2=O.C38=O.C47=O.N26.N35.C59
|
CO[C@H](C)CC(=O)NCC(=O)NOC[C@@H](O)C(C)C
|
CO[C@H]C)CC=O)NCC=O)NOC[C@@H]O)CC)C
|
[C][O][C@H1][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][O][C][C@@H1][Branch1][C][O][C][Branch1][C][C][C]
|
C2(C)CC1=O.C4C(=O)NO3.C3C(O)C(C)C.CO2.N14
|
CCn1ccnc1C(=O)N[C@]12CCC[C@H]1N(C(=O)CC[C@H]1CC1(F)F)CCC2
|
CCnccnc5C=O)N[C@]CCC[C@H]5NC=O)CC[C@H]CC3F)F)))))))CCC9
|
[C][C][N][C][=C][N][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C@][C][C][C][C@H1][Ring1][Branch1][N][Branch1][S][C][=Branch1][C][=O][C][C][C@H1][C][C][Ring1][Ring1][Branch1][C][F][F][C][C][C][Ring2][Ring1][C]
|
C125CCCC1N4CCC2.n17ccnc16.C4(=O)CC8.C18CC1(F)F.C36=O.CC7.N35
|
CC1([C@@H]2C[C@H]2C(=O)N2C[C@H](C(=O)NCC[C@@H]3CCCCO3)C3(CCC3)C2)COC1
|
CC[C@@H]C[C@H]3C=O)NC[C@H]C=O)NCC[C@@H]CCCCO6))))))))))CCCC4)))C5)))))))))COC4
|
[C][C][Branch2][Ring2][#Branch2][C@@H1][C][C@H1][Ring1][Ring1][C][=Branch1][C][=O][N][C][C@H1][Branch1][S][C][=Branch1][C][=O][N][C][C][C@@H1][C][C][C][C][O][Ring1][=Branch1][C][Branch1][=Branch1][C][C][C][Ring1][Ring2][C][Ring2][Ring1][Ring1][C][O][C][Ring2][Ring1][N]
|
N14CC8C2(CCC2)C1.CC1(C2CC27)COC1.C19CCCCO1.C47=O.C58=O.C6C9.N56
|
CN(C(=O)c1cncn1C)[C@H]1CCN(C(=O)CCc2cc(Cl)ccc2Cl)C1
|
CNC=O)ccncn5C)))))))[C@H]CCNC=O)CCcccCl)ccc6Cl))))))))))C5
|
[C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][N][=C][N][Ring1][Branch1][C][C@H1][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C][C][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][Cl][C][Ring1][P]
|
c17cc(Cl)ccc1Cl.c16cncn1C.C15CCN4C1.C4(=O)CC7.CN35.C36=O
|
Cc1cc(C(=O)NC[C@@](C)(O)CNC(=O)c2cnc3cc[nH]c3c2)c(F)cc1Cl
|
CcccC=O)NC[C@@]C)O)CNC=O)ccnccc[nH]c5c9))))))))))))))))cF)cc6Cl
|
[C][C][=C][C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C@@][Branch1][C][C][Branch1][C][O][C][N][C][=Branch1][C][=O][C][=C][N][=C][C][=C][NH1][C][Ring1][Branch1][=C][Ring1][=Branch2][=C][Branch1][C][F][C][=C][Ring2][Ring1][O][Cl]
|
Cc1cc8c(F)cc1Cl.c19cnc2cc[nH]c2c1.C6C(C)(O)C7.C48=O.C59=O.N46.N57
|
CCc1c[nH]nc1C(=O)N[C@H](CO)C(=O)N[C@@H](C)CC1CC1
|
CCcc[nH]nc5C=O)N[C@H]CO))C=O)N[C@@H]C)CCCC3
|
[C][C][C][=C][NH1][N][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C@H1][Branch1][Ring1][C][O][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][C][C][C][Ring1][Ring1]
|
c18c[nH]nc16.C4(CO)C3=O.C5(C)C7.C26=O.C17CC1.CC8.N24.N35
|
CC(C)NC(=O)C(=O)NCC1(CNC(=O)c2nnn3c2CCC3)CC1
|
CCC)NC=O)C=O)NCCCNC=O)cnnnc5CCC5)))))))))))CC3
|
[C][C][Branch1][C][C][N][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][Ring1][C][N][C][=Branch1][C][=O][C][N][=N][N][C][=Ring1][Branch1][C][C][C][Ring1][Branch1][C][C][Ring1][#C]
|
c1%10nnn2c1CCC2.C4(=O)C5=O.C1%11%12CC1.CC7C.C6%10=O.N47.N58.C8%11.C9%12.N69
|
C[C@@](CO)(NC(=O)[C@H](CC1CC1)NC(=O)c1ncncc1Cl)C(F)(F)F
|
C[C@@]CO))NC=O)[C@H]CCCC3))))NC=O)cncncc6Cl))))))))))))CF)F)F
|
[C][C@@][Branch1][Ring1][C][O][Branch2][Ring1][=N][N][C][=Branch1][C][=O][C@H1][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][N][C][=Branch1][C][=O][C][=N][C][=N][C][=C][Ring1][=Branch1][Cl][C][Branch1][C][F][Branch1][C][F][F]
|
CC4(CO)C(F)(F)F.c16ncncc1Cl.C2(=O)C5C7.C17CC1.C36=O.N24.N35
|
CC[C@@H]1CN(C(=O)C(=O)NCC2CC2)CC[C@@H]1NC(=O)Cc1cc(C)ccc1F
|
CC[C@@H]CNC=O)C=O)NCCCC3)))))))CC[C@@H]6NC=O)CcccC)ccc6F
|
[C][C][C@@H1][C][N][Branch1][S][C][=Branch1][C][=O][C][=Branch1][C][=O][N][C][C][C][C][Ring1][Ring1][C][C][C@@H1][Ring1][#C][N][C][=Branch1][C][=O][C][C][=C][C][Branch1][C][C][=C][C][=C][Ring1][#Branch1][F]
|
C18CN3CCC17.c1%10cc(C)ccc1F.C3(=O)C4=O.C5(=O)C%10.C19CC1.CC8.N46.C69.N57
|
CC(C)[C@H](C(=O)NC[C@H]1CCN(C(=O)CC(C)(C)C2CC2)C1)c1cccnc1
|
CCC)[C@H]C=O)NC[C@H]CCNC=O)CCC)C)CCC3))))))C5))))))))ccccnc6
|
[C][C][Branch1][C][C][C@H1][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C@H1][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][C][Branch1][C][C][Branch1][C][C][C][C][C][Ring1][Ring1][C][Ring1][=C][C][=C][C][=C][N][=C][Ring1][=Branch1]
|
CC(C)C8C3=O.C4(=O)CC7(C)C.C16CCN4C1.c18cccnc1.C17CC1.N35.C56
|
Cc1nc(O)sc1S(=O)(=O)NCCNC(=O)N1C[C@H](C)C12CCC2
|
CcncO)sc5S=O)=O)NCCNC=O)NC[C@H]C)C4CCC4
|
[C][C][N][=C][Branch1][C][O][S][C][=Ring1][=Branch1][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][N][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][C][Ring1][Branch1][C][C][C][Ring1][Ring2]
|
Cc1nc(O)sc1S7(=O)=O.N14CC(C)C12CCC2.C5C6.C34=O.N57.N36
|
CCc1ccc(F)c(C(=O)N[C@@H](C)[C@@H](O)C(=O)O)c1F
|
CCccccF)cC=O)N[C@@H]C)[C@@H]O)C=O)O))))))c6F
|
[C][C][C][=C][C][=C][Branch1][C][F][C][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C@@H1][Branch1][C][O][C][=Branch1][C][=O][O][=C][Ring1][P][F]
|
c15ccc(F)c4c1F.C3(C)C(O)C(=O)O.C24=O.CC5.N23
|
CC[C@@H](C)CCCC(=O)NC1(C)CCN(C(=O)[C@@H](C)OCC(F)(F)F)CC1
|
CC[C@@H]C)CCCC=O)NCC)CCNC=O)[C@@H]C)OCCF)F)F))))))CC6
|
[C][C][C@@H1][Branch1][C][C][C][C][C][C][=Branch1][C][=O][N][C][Branch1][C][C][C][C][N][Branch2][Ring1][Ring1][C][=Branch1][C][=O][C@@H1][Branch1][C][C][O][C][C][Branch1][C][F][Branch1][C][F][F][C][C][Ring1][P]
|
CCC(C)CCCC2=O.C16(C)CCN3CC1.C3(=O)C4C.C5C(F)(F)F.N26.O45
|
CC(=Cn1ccnn1)C(=O)N[C@@H](C)CNC(=O)c1nccn2nccc12
|
CC=Cnccnn5))))))C=O)N[C@@H]C)CNC=O)cnccnnccc95
|
[C][C][=Branch1][=Branch2][=C][N][C][=C][N][=N][Ring1][Branch1][C][=Branch1][C][=O][N][C@@H1][Branch1][C][C][C][N][C][=Branch1][C][=O][C][=N][C][=C][N][N][=C][C][=C][Ring1][=Branch2][Ring1][Branch1]
|
CC(=Cn1ccnn1)C3=O.c17nccn2nccc12.C5(C)C6.C47=O.N35.N46
|
C=CC[C@H](C(=O)N[C@H]1CC[C@H](NC(=O)[C@@H](O)c2ccco2)CC1)C(C)C
|
C=CC[C@H]C=O)N[C@H]CC[C@H]NC=O)[C@@H]O)cccco5))))))))CC6))))))))CC)C
|
[C][=C][C][C@H1][Branch2][Ring1][S][C][=Branch1][C][=O][N][C@H1][C][C][C@H1][Branch1][P][N][C][=Branch1][C][=O][C@@H1][Branch1][C][O][C][=C][C][=C][O][Ring1][Branch1][C][C][Ring1][S][C][Branch1][C][C][C]
|
C=CCC(C3=O)C(C)C.C15CCC6CC1.C4(=O)C7O.c17ccco1.N35.N46
|
O=C(N1CCC(OC2CCC2)CC1)C12COC(CF)(C1)C2
|
O=CNCCCOCCCC4)))))CC6))))))CCOCCF))C5)C5
|
[O][=C][Branch2][Ring1][C][N][C][C][C][Branch1][Branch2][O][C][C][C][C][Ring1][Ring2][C][C][Ring1][O][C][C][O][C][Branch1][Ring1][C][F][Branch1][Ring2][C][Ring1][#Branch1][C][Ring1][Branch2]
|
N13CCC4CC1.C126COC7(C1)C2.C15CCC1.O=C36.O45.C7F
|
C[C@@H](NS(=O)(=O)c1ccc(F)cc1)C(=O)N[C@H](CS(C)(=O)=O)C(C)(C)C
|
C[C@@H]NS=O)=O)ccccF)cc6))))))))C=O)N[C@H]CSC)=O)=O)))CC)C)C
|
[C][C@@H1][Branch2][Ring1][Ring2][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C@H1][Branch1][#Branch2][C][S][Branch1][C][C][=Branch1][C][=O][=O][C][Branch1][C][C][Branch1][C][C][C]
|
S5(=O)(=O)c1ccc(F)cc1.C4(CS(C)(=O)=O)C(C)(C)C.CC3C2=O.N35.N24
|
CC[C@@H]1[C@@H](NC(=O)[C@H]2CCOC2)CCN1C(=O)c1cnc2ccc(Br)cc2c1
|
CC[C@@H][C@@H]NC=O)[C@H]CCOC5)))))))CCN5C=O)ccnccccBr)cc6c%10
|
[C][C][C@@H1][C@@H1][Branch1][=N][N][C][=Branch1][C][=O][C@H1][C][C][O][C][Ring1][Branch1][C][C][N][Ring1][=N][C][=Branch1][C][=O][C][=C][N][=C][C][=C][C][Branch1][C][Br][=C][C][Ring1][#Branch1][=C][Ring1][O]
|
c17cnc2ccc(Br)cc2c1.C18C5CCN14.C16CCOC1.C36=O.C47=O.CC8.N35
|
COCCN(CCNC(=O)c1sccc1Cl)C(=O)c1cnnn1C
|
COCCNCCNC=O)csccc5Cl))))))))))C=O)ccnnn5C
|
[C][O][C][C][N][Branch1][S][C][C][N][C][=Branch1][C][=O][C][S][C][=C][C][=Ring1][Branch1][Cl][C][=Branch1][C][=O][C][=C][N][=N][N][Ring1][Branch1][C]
|
c18sccc1Cl.c19cnnn1C.C4C5.N356.C6C7.C28=O.C39=O.CO4.N27
|
C=CC1(CC(=O)N2C[C@@H](C(F)(F)F)[C@H](CNC(=O)C(C)(F)F)C2)CCCCC1
|
C=CCCC=O)NC[C@@H]CF)F)F))[C@H]CNC=O)CC)F)F)))))C5)))))))CCCCC6
|
[C][=C][C][Branch2][Ring2][#Branch1][C][C][=Branch1][C][=O][N][C][C@@H1][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C@H1][Branch1][#C][C][N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][F][F][C][Ring1][P][C][C][C][C][C][Ring2][Ring1][#Branch2]
|
C=CC16CCCCC1.N13CC7C8C1.C4(=O)C(C)(F)F.C6C3=O.C7(F)(F)F.C58.N45
|
COc1ccccc1SCC(=O)N1CC[C@H](C2CC2)[C@H]1CNC(=O)C1=CCSC1
|
COcccccc6SCC=O)NCC[C@H]CCC3)))[C@H]5CNC=O)C=CCSC5
|
[C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][S][C][C][=Branch1][C][=O][N][C][C][C@H1][Branch1][=Branch1][C][C][C][Ring1][Ring1][C@H1][Ring1][Branch2][C][N][C][=Branch1][C][=O][C][=C][C][S][C][Ring1][Branch1]
|
N13CCC(C2CC2)C18.c15ccccc19.C4(=O)C1=CCSC1.C7C3=O.CO5.S79.C68.N46
|
Cn1ccnc1CCC(=O)N1CCC[C@@H]([C@](C)(O)CNC(=O)COCCCF)C1
|
Cnccnc5CCC=O)NCCC[C@@H][C@]C)O)CNC=O)COCCCF))))))))))C6
|
[C][N][C][=C][N][=C][Ring1][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][C@@H1][Branch2][Ring1][Ring2][C@][Branch1][C][C][Branch1][C][O][C][N][C][=Branch1][C][=O][C][O][C][C][C][F][C][Ring2][Ring1][Ring1]
|
N12CCCC8C1.Cn1ccnc17.C7CC2=O.C8(C)(O)C6.C3(=O)C4.C5CCF.N36.O45
|
N#Cc1cnc(NC[C@](O)(C2CCC(F)(F)CC2)C(F)(F)F)c(C#N)c1
|
N#CccncNC[C@]O)CCCCF)F)CC6))))))CF)F)F)))))cC#N))c6
|
[N][#C][C][=C][N][=C][Branch2][Ring1][#C][N][C][C@][Branch1][C][O][Branch1][#C][C][C][C][C][Branch1][C][F][Branch1][C][F][C][C][Ring1][Branch2][C][Branch1][C][F][Branch1][C][F][F][C][Branch1][Ring1][C][#N][=C][Ring2][Ring1][Branch2]
|
N#Cc1cnc4c(C#N)c1.C3C5(O)C(F)(F)F.C15CCC(F)(F)CC1.N34
|
COCCCC(=O)N1C[C@H](C)[C@@H](NC(=O)c2ccc(Cl)cc2O)[C@H](C)C1
|
COCCCC=O)NC[C@H]C)[C@@H]NC=O)ccccCl)cc6O)))))))))[C@H]C)C6
|
[C][O][C][C][C][C][=Branch1][C][=O][N][C][C@H1][Branch1][C][C][C@@H1][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][O][C@H1][Branch1][C][C][C][Ring2][Ring1][Ring1]
|
N13CC(C)C6C(C)C1.c17ccc(Cl)cc1O.C5CCC3=O.C47=O.CO5.N46
|
C[C@@H](CCCCNC(=O)[C@@H](C)C1=CCCC1)NC(=O)C1(S(C)(=O)=O)CCC1
|
C[C@@H]CCCCNC=O)[C@@H]C)C=CCCC5))))))))))))NC=O)CSC)=O)=O))CCC4
|
[C][C@@H1][Branch2][Ring1][Branch1][C][C][C][C][N][C][=Branch1][C][=O][C@@H1][Branch1][C][C][C][=C][C][C][C][Ring1][Branch1][N][C][=Branch1][C][=O][C][Branch1][=Branch2][S][Branch1][C][C][=Branch1][C][=O][=O][C][C][C][Ring1][Branch2]
|
C2(=O)C(C)C1=CCCC1.C16(S(C)(=O)=O)CCC1.CC4CCCC5.C36=O.N25.N34
|
CCC1(C(=O)N[C@@H]2CCCN(CC[C@H](C)F)[C@H]2C)CCC1
|
CCCC=O)N[C@@H]CCCNCC[C@H]C)F))))[C@H]6C)))))))))CCC4
|
[C][C][C][Branch2][Ring1][Branch2][C][=Branch1][C][=O][N][C@@H1][C][C][C][N][Branch1][Branch2][C][C][C@H1][Branch1][C][C][F][C@H1][Ring1][O][C][C][C][C][Ring2][Ring1][Ring1]
|
C15CCCN4C1C.C167CCC1.C4CC(C)F.C36=O.CC7.N35
|
C=CCC1(C(=O)N[C@@H](CCN(C)C(=O)CCn2cnc(C)cc2=O)C(C)C)CC1
|
C=CCCC=O)N[C@@H]CCNC)C=O)CCncncC)cc6=O)))))))))))))CC)C)))))CC3
|
[C][=C][C][C][Branch2][Ring2][#Branch1][C][=Branch1][C][=O][N][C@@H1][Branch2][Ring1][=Branch2][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][N][C][=N][C][Branch1][C][C][=C][C][Ring1][#Branch1][=O][C][Branch1][C][C][C][C][C][Ring2][Ring1][#Branch2]
|
n18cnc(C)cc1=O.C5(CC6)C(C)C.C4(=O)CC8.C179CC1.C=CC9.C37=O.N46C.N35
|
CC(=O)O[C@H]1CN(C(=O)C(C)(F)F)C[C@H]1n1cc([C@@H](C2CC2)N(C)C)nn1
|
CC=O)O[C@H]CNC=O)CC)F)F)))C[C@H]5ncc[C@@H]CCC3)))NC)C)))nn5
|
[C][C][=Branch1][C][=O][O][C@H1][C][N][Branch1][=N][C][=Branch1][C][=O][C][Branch1][C][C][Branch1][C][F][F][C][C@H1][Ring1][O][N][C][=C][Branch1][=C][C@@H1][Branch1][=Branch1][C][C][C][Ring1][Ring1][N][Branch1][C][C][C][N][=N][Ring1][N]
|
C15CN4CC19.C4(=O)C(C)(F)F.n19cc7nn1.CC3=O.C678.C18CC1.N6(C)C.O35
|
CC1(C)C(O)C(C)(C)C1NC(=O)C#CCNC(=O)CC1(C#N)CC1
|
CCC)CO)CC)C)C4NC=O)C#CCNC=O)CCC#N))CC3
|
[C][C][Branch1][C][C][C][Branch1][C][O][C][Branch1][C][C][Branch1][C][C][C][Ring1][Branch2][N][C][=Branch1][C][=O][C][#C][C][N][C][=Branch1][C][=O][C][C][Branch1][Ring1][C][#N][C][C][Ring1][Branch1]
|
CC1(C)C5C(C)(C)C1O.C2(=O)C#CC4.C16(C#N)CC1.C3(=O)C6.N25.N34
|
Cc1ccoc1CC(=O)N1CCCC[C@@H]1CN(C)C(=O)[C@H]1CCCSC1
|
Ccccoc5CC=O)NCCCC[C@@H]6CNC)C=O)[C@H]CCCSC6
|
[C][C][C][=C][O][C][=Ring1][Branch1][C][C][=Branch1][C][=O][N][C][C][C][C][C@@H1][Ring1][=Branch1][C][N][Branch1][C][C][C][=Branch1][C][=O][C@H1][C][C][C][S][C][Ring1][=Branch1]
|
N12CCCCC16.Cc1ccoc17.C15CCCSC1.C7C2=O.N34C.C35=O.C46
|
O=C(C[C@H]1CCCN1C(=O)CC1CCC1)NCC[C@H](O)C(F)F
|
O=CC[C@H]CCCN5C=O)CCCCC4))))))))))))NCC[C@H]O)CF)F
|
[O][=C][Branch2][Ring1][Ring2][C][C@H1][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][C][C][C][C][Ring1][Ring2][N][C][C][C@H1][Branch1][C][O][C][Branch1][C][F][F]
|
C4CC(O)C(F)F.C15CCCN13.O=C2C5.C3(=O)C6.C16CCC1.N24
|
COC[C@](C)(O)C(=O)N1CC2(C1)SCC[C@H]2NC(=O)CSCc1ccc(C)cc1
|
COC[C@]C)O)C=O)NCCC4)SCC[C@H]5NC=O)CSCccccC)cc6
|
[C][O][C][C@][Branch1][C][C][Branch1][C][O][C][=Branch1][C][=O][N][C][C][Branch1][Ring2][C][Ring1][Ring2][S][C][C][C@H1][Ring1][=Branch1][N][C][=Branch1][C][=O][C][S][C][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1]
|
N13CC2(C1)SCCC28.C5C(C)(O)C3=O.c19ccc(C)cc1.C4(=O)C6.CO5.N48.S67.C79
|