ID large_stringlengths 1 7 | smiles stringlengths 15 57 | selfies stringlengths 55 294 | safe stringlengths 15 83 |
|---|---|---|---|
1928497 | CCc1n[nH]c(C(=O)NC(C)C2=CCCCC2)c1C | [C][C][C][=N][NH1][C][Branch2][Ring1][C][C][=Branch1][C][=O][N][C][Branch1][C][C][C][=C][C][C][C][C][Ring1][=Branch1][=C][Ring1][S][C] | C4(C)C1=CCCCC1.c16n[nH]c5c1C.C35=O.CC6.N34 |
1928498 | CCn1cc(Nc2nc3c(s2)c(C)nn3C)c(C)n1 | [C][C][N][C][=C][Branch2][Ring1][Ring2][N][C][=N][C][=C][Branch1][Ring2][S][Ring1][Branch1][C][Branch1][C][C][=N][N][Ring1][#Branch1][C][C][Branch1][C][C][=N][Ring1][P] | c14nc2c(s1)c(C)nn2C.n16cc5c(C)n1.CC6.N45 |
1928499 | CNC(=O)C1(NC(=O)c2ccnc(NC)c2)CCCCC1 | [C][N][C][=Branch1][C][=O][C][Branch2][Ring1][C][N][C][=Branch1][C][=O][C][=C][C][=N][C][Branch1][Ring1][N][C][=C][Ring1][Branch2][C][C][C][C][C][Ring1][P] | C157CCCCC1.c18ccnc6c1.C37=O.C48=O.CN3.N45.N6C |
1928500 | CCOc1ccc(NC(=O)NCCc2n[nH]c(C)n2)c(F)c1 | [C][C][O][C][=C][C][=C][Branch2][Ring1][Ring1][N][C][=Branch1][C][=O][N][C][C][C][=N][NH1][C][Branch1][C][C][=N][Ring1][=Branch1][C][Branch1][C][F][=C][Ring2][Ring1][Ring1] | c16ccc8c(F)c1.c19n[nH]c(C)n1.C34=O.C7C9.CC5.O56.N38.N47 |
1928501 | Cc1nn(CCC(N)=O)c(C)c1-c1ccc2c(c1)OCO2 | [C][C][=N][N][Branch1][Branch2][C][C][C][Branch1][C][N][=O][C][Branch1][C][C][=C][Ring1][O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][O][Ring1][=Branch1] | c14ccc2c(c1)OCO2.Cc1nn3c(C)c14.C3CC(N)=O |
1928503 | Cc1nc(CNc2nc3c(s2)c(C)nn3C)no1 | [C][C][=N][C][Branch2][Ring1][Branch1][C][N][C][=N][C][=C][Branch1][Ring2][S][Ring1][Branch1][C][Branch1][C][C][=N][N][Ring1][#Branch1][C][=N][O][Ring1][P] | c15nc2c(s1)c(C)nn2C.Cc1nc6no1.C46.N45 |
1928504 | CCN(CC)C(=O)C1CC(NC(=O)c2cnccn2)CN1C | [C][C][N][Branch1][Ring1][C][C][C][=Branch1][C][=O][C][C][C][Branch1][=C][N][C][=Branch1][C][=O][C][=C][N][=C][C][=N][Ring1][=Branch1][C][N][Ring1][=C][C] | C18CC7CN1C.c19cnccn1.N356.C38=O.C49=O.CC5.C6C.N47 |
1928505 | COc1cc(OC)nc(N(C)CC2(CO)CCOCC2)n1 | [C][O][C][=C][C][Branch1][Ring1][O][C][=N][C][Branch2][Ring1][C][N][Branch1][C][C][C][C][Branch1][Ring1][C][O][C][C][O][C][C][Ring1][Branch2][=N][Ring2][Ring1][Ring1] | c13cc4nc6n1.C178CCOCC1.N56C.CO3.O4C.C57.C8O |
1928506 | O=c1cccc(-c2nc(C3CCOCC3)nn2C2CCCCC2)[nH]1 | [O][=C][C][=C][C][=C][Branch2][Ring1][#Branch2][C][=N][C][Branch1][=Branch2][C][C][C][O][C][C][Ring1][=Branch1][=N][N][Ring1][O][C][C][C][C][C][C][Ring1][=Branch1][NH1][Ring2][Ring1][#Branch1] | O=c1cccc5[nH]1.c15nc6nn14.C16CCOCC1.C14CCCCC1 |
1928507 | COCc1nc(CNC(=O)C2CCOc3ccccc3C2)no1 | [C][O][C][C][=N][C][Branch2][Ring1][=Branch1][C][N][C][=Branch1][C][=O][C][C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][O][=N][O][Ring2][Ring1][Ring2] | C17CCOc2ccccc2C1.c18nc9no1.C47=O.CO5.C58.C69.N46 |
1928508 | Oc1ccc(-c2ccnc(N3CCOCC3)c2F)cc1 | [O][C][=C][C][=C][Branch2][Ring1][Ring2][C][=C][C][=N][C][Branch1][=Branch2][N][C][C][O][C][C][Ring1][=Branch1][=C][Ring1][N][F][C][=C][Ring2][Ring1][Ring1] | c15ccnc4c1F.Oc1ccc5cc1.N14CCOCC1 |
1928509 | CCn1nc(C)c(CCNC(=O)Cc2csc(C)n2)c1C | [C][C][N][N][=C][Branch1][C][C][C][Branch2][Ring1][Ring1][C][C][N][C][=Branch1][C][=O][C][C][=C][S][C][Branch1][C][C][=N][Ring1][=Branch1][=C][Ring2][Ring1][C][C] | n15nc(C)c7c1C.c16csc(C)n1.C3(=O)C6.C7C4.CC5.N34 |
1928510 | CCc1nc(C)sc1CNC(=O)Nc1ccc2c(c1)OCCO2 | [C][C][C][N][=C][Branch1][C][C][S][C][=Ring1][=Branch1][C][N][C][=Branch1][C][=O][N][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][O][Ring1][#Branch1] | c16ccc2c(c1)OCCO2.c17nc(C)sc18.C34=O.CC7.C58.N35.N46 |
1928511 | CCc1nc(-c2noc3ccc(C(=O)NC4CCCC4)cc23)co1 | [C][C][C][=N][C][Branch2][Ring1][N][C][=N][O][C][=C][C][=C][Branch1][=N][C][=Branch1][C][=O][N][C][C][C][C][C][Ring1][Branch1][C][=C][Ring1][P][Ring1][=C][=C][O][Ring2][Ring1][=Branch1] | c19noc2ccc7cc12.c18nc9co1.C16CCCC1.C57=O.CC8.N56 |
1928513 | Cc1nc(-c2cc(C(=O)N3CCCC3)c3ccccn23)cs1 | [C][C][=N][C][Branch2][Ring1][O][C][=C][C][Branch1][N][C][=Branch1][C][=O][N][C][C][C][C][Ring1][Branch1][=C][C][=C][C][=C][N][Ring1][S][Ring1][=Branch1][=C][S][Ring2][Ring1][Branch1] | c16cc5c2ccccn12.Cc1nc6cs1.N14CCCC1.C45=O |
1928514 | CCc1nc(-c2cc(C(=O)NC3CC3)c3ccccn23)cs1 | [C][C][C][=N][C][Branch2][Ring1][#Branch2][C][=C][C][Branch1][O][C][=Branch1][C][=O][N][C][C][C][Ring1][Ring1][=C][C][=C][C][=C][N][Ring1][#C][Ring1][=Branch1][=C][S][Ring2][Ring1][Ring2] | c18cc6c2ccccn12.c17nc8cs1.C46=O.C15CC1.CC7.N45 |
1928515 | CCc1nc(-c2cc(C(=O)N3CCCC3)c3ccccn23)cs1 | [C][C][C][=N][C][Branch2][Ring1][O][C][=C][C][Branch1][N][C][=Branch1][C][=O][N][C][C][C][C][Ring1][Branch1][=C][C][=C][C][=C][N][Ring1][S][Ring1][=Branch1][=C][S][Ring2][Ring1][Branch1] | c17cc5c2ccccn12.c16nc7cs1.N14CCCC1.C45=O.CC6 |
1928516 | CCc1nc(-c2cc(C(=O)N3CCCCC3)c3ccccn23)cs1 | [C][C][C][=N][C][Branch2][Ring1][N][C][=C][C][Branch1][=N][C][=Branch1][C][=O][N][C][C][C][C][C][Ring1][=Branch1][=C][C][=C][C][=C][N][Ring1][P][Ring1][=Branch1][=C][S][Ring2][Ring1][=Branch1] | c17cc5c2ccccn12.c16nc7cs1.N14CCCCC1.C45=O.CC6 |
1928517 | CC(C)c1nc(-c2cc(C(=O)N3CCCC3)c3ccccn23)cs1 | [C][C][Branch1][C][C][C][=N][C][Branch2][Ring1][O][C][=C][C][Branch1][N][C][=Branch1][C][=O][N][C][C][C][C][Ring1][Branch1][=C][C][=C][C][=C][N][Ring1][S][Ring1][=Branch1][=C][S][Ring2][Ring1][Branch1] | c17cc5c2ccccn12.c16nc7cs1.N14CCCC1.CC6C.C45=O |
1928518 | CCCNC(=O)c1ccn(-c2ccc3ccc(-c4cccnc4)cn23)n1 | [C][C][C][N][C][=Branch1][C][=O][C][C][=C][N][Branch2][Ring1][Branch2][C][=C][C][=C][C][=C][C][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][=C][N][Ring1][#C][Ring1][N][N][=Ring2][Ring1][Ring2] | c18ccc2ccc9cn12.c17ccn8n1.c19cccnc1.CCC6.C57=O.N56 |
1928519 | CCCNC(=O)c1ccn(-c2ccc3ccc(-c4ccncc4)cn23)n1 | [C][C][C][N][C][=Branch1][C][=O][C][C][=C][N][Branch2][Ring1][Branch2][C][=C][C][=C][C][=C][C][Branch1][=Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][=C][N][Ring1][#C][Ring1][N][N][=Ring2][Ring1][Ring2] | c18ccc2ccc9cn12.c17ccn8n1.c19ccncc1.CCC6.C57=O.N56 |
1928520 | CC(C)NC(=O)c1ccn(-c2ccc3ccc(-c4ccncc4)cn23)n1 | [C][C][Branch1][C][C][N][C][=Branch1][C][=O][C][C][=C][N][Branch2][Ring1][Branch2][C][=C][C][=C][C][=C][C][Branch1][=Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][=C][N][Ring1][#C][Ring1][N][N][=Ring2][Ring1][Ring2] | c18ccc2ccc9cn12.c17ccn8n1.c19ccncc1.CC6C.C57=O.N56 |
1928521 | COCCN(C)c1nc(C2CCN(C(C)=O)CC2)cc2c1ncn2C | [C][O][C][C][N][Branch1][C][C][C][=N][C][Branch1][S][C][C][C][N][Branch1][=Branch1][C][Branch1][C][C][=O][C][C][Ring1][=Branch2][=C][C][=C][Ring1][#C][N][=C][N][Ring1][Branch1][C] | c16nc7cc2c1ncn2C.C17CCN3CC1.C4C5.N56C.C3(C)=O.CO4 |
1928522 | COCCN1CCN(c2ccc3ccc(C(=O)NC4CC4)cn23)CC1 | [C][O][C][C][N][C][C][N][Branch2][Ring1][#Branch2][C][=C][C][=C][C][=C][C][Branch1][O][C][=Branch1][C][=O][N][C][C][C][Ring1][Ring1][=C][N][Ring1][#C][Ring1][N][C][C][Ring2][Ring1][Branch1] | c18ccc2ccc%10cn12.N17CCN8CC1.C6C7.C5%10=O.C19CC1.CO6.N59 |
1928523 | CCCC(=O)N1CCC2(CC1)CC(NC(C)=O)c1ccccc1O2 | [C][C][C][C][=Branch1][C][=O][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][C][Branch1][#Branch1][N][C][Branch1][C][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][O][Ring1][S] | N13CCC2(CC1)CC(N4)c1ccccc1O2.CCCC3=O.C4(C)=O |
1928524 | CN1CCOC2(CCCN(C(=O)c3cccc(C(F)(F)F)c3)C2)C1 | [C][N][C][C][O][C][Branch2][Ring2][C][C][C][C][N][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][#Branch2][C][Ring2][Ring1][C][C][Ring2][Ring1][#Branch1] | CN1CCOC2(CCCN4C2)C1.c15cccc6c1.C6(F)(F)F.C45=O |
1928525 | CN(C)C(=O)N1CCC2(CC1)NC(=O)c1ccccc12 | [C][N][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][N] | N14CCC2(CC1)NC(=O)c1ccccc12.CN3C.C34=O |
1928526 | O=C(c1cscn1)N1CCC2(CCN(c3ncccn3)CC2)C1 | [O][=C][Branch1][Branch2][C][=C][S][C][=N][Ring1][Branch1][N][C][C][C][Branch2][Ring1][C][C][C][N][Branch1][=Branch2][C][=N][C][=C][C][=N][Ring1][=Branch1][C][C][Ring1][N][C][Ring1][S] | N14CCC2(CCN5CC2)C1.c15ncccn1.c16cscn1.O=C46 |
1928527 | O=C(c1cscn1)N1CCC2(CCN(c3ncc(F)cn3)CC2)C1 | [O][=C][Branch1][Branch2][C][=C][S][C][=N][Ring1][Branch1][N][C][C][C][Branch2][Ring1][Branch1][C][C][N][Branch1][N][C][=N][C][=C][Branch1][C][F][C][=N][Ring1][#Branch1][C][C][Ring1][=N][C][Ring1][P] | N14CCC2(CCN5CC2)C1.c15ncc(F)cn1.c16cscn1.O=C46 |
1928528 | O=C(c1cccnc1)N1CCC2(CC1)CCN(c1ncc(F)cn1)C2 | [O][=C][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][C][N][Branch1][N][C][=N][C][=C][Branch1][C][F][C][=N][Ring1][#Branch1][C][Ring1][=C] | N13CCC2(CC1)CCN4C2.c14ncc(F)cn1.c15cccnc1.O=C35 |
1928529 | Cc1cnc(N2CCC3(CCN(C(=O)c4cccnc4)CC3)C2)nc1 | [C][C][=C][N][=C][Branch2][Ring1][P][N][C][C][C][Branch2][Ring1][=Branch1][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][C][=C][N][=C][Ring1][=Branch1][C][C][Ring1][=C][C][Ring2][Ring1][C][N][=C][Ring2][Ring1][Branch2] | N16CCC2(CCN5CC2)C1.Cc1cnc6nc1.c17cccnc1.C57=O |
1928530 | O=C(C1CCOC1)N1CCC2(CCN(c3ncccn3)CC2)C1 | [O][=C][Branch1][Branch2][C][C][C][O][C][Ring1][Branch1][N][C][C][C][Branch2][Ring1][C][C][C][N][Branch1][=Branch2][C][=N][C][=C][C][=N][Ring1][=Branch1][C][C][Ring1][N][C][Ring1][S] | N14CCC2(CCN5CC2)C1.c15ncccn1.C16CCOC1.O=C46 |
1928531 | Cc1cnc(C(=O)N2CCC3(CC2)CCN(CC2CC2)C3=O)cn1 | [C][C][=C][N][=C][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][C][N][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][C][Ring1][O][=O][C][=N][Ring2][Ring1][#Branch1] | N14CCC2(CC1)CCN6C2=O.Cc1cnc5cn1.C45=O.C17CC1.C67 |
1928532 | O=C(c1cnccn1)N1CCC2(CC1)CCN(CC1CC1)C2=O | [O][=C][Branch1][=Branch2][C][=C][N][=C][C][=N][Ring1][=Branch1][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][C][N][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][C][Ring1][O][=O] | N13CCC2(CC1)CCN5C2=O.c14cnccn1.O=C34.C16CC1.C56 |
1928533 | COc1cc(N2CCC3(CC2)CCN(c2cccnc2)C3=O)ncn1 | [C][O][C][=C][C][Branch2][Ring1][N][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][C][N][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][C][Ring1][=N][=O][=N][C][=N][Ring2][Ring1][#Branch1] | N15CCC2(CC1)CCN6C2=O.c14cc5ncn1.c16cccnc1.CO4 |
1928535 | O=C(c1cccnc1)N1CCC2(CC1)CCN(c1cccnc1)C2=O | [O][=C][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][C][N][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][C][Ring1][=N][=O] | N13CCC2(CC1)CCN5C2=O.c14cccnc1.c15cccnc1.O=C34 |
1928536 | O=C(c1ccoc1)N1CCC2(CC1)CCN(c1cncnc1)C2=O | [O][=C][Branch1][Branch2][C][C][=C][O][C][=Ring1][Branch1][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][C][N][Branch1][=Branch2][C][=C][N][=C][N][=C][Ring1][=Branch1][C][Ring1][=N][=O] | N13CCC2(CC1)CCN5C2=O.c15cncnc1.c14ccoc1.O=C34 |
1928537 | Cc1occc1C(=O)N1CCC2(CC1)CCN(c1cncnc1)C2=O | [C][C][O][C][=C][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][C][N][Branch1][=Branch2][C][=C][N][=C][N][=C][Ring1][=Branch1][C][Ring1][=N][=O] | N13CCC2(CC1)CCN5C2=O.Cc1occc14.c15cncnc1.C34=O |
1928538 | O=C(c1cscn1)N1CCC2(CC1)CCN(c1ccsc1)C2=O | [O][=C][Branch1][Branch2][C][=C][S][C][=N][Ring1][Branch1][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][C][N][Branch1][Branch2][C][C][=C][S][C][=Ring1][Branch1][C][Ring1][N][=O] | N13CCC2(CC1)CCN5C2=O.c14cscn1.c15ccsc1.O=C34 |
1928539 | Cn1cc(N2CCC3(CCN(C(=O)c4ccco4)CC3)C2=O)cn1 | [C][N][C][=C][Branch2][Ring1][S][N][C][C][C][Branch2][Ring1][Branch1][C][C][N][Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][O][Ring1][Branch1][C][C][Ring1][=N][C][Ring1][P][=O][C][=N][Ring2][Ring1][#Branch1] | N17CCC2(CCN5CC2)C1=O.Cn1cc7cn1.c16ccco1.C56=O |
1928540 | Cc1ccc(N2CCC3(CCCN(C(=O)c4cnccn4)C3)C2)nn1 | [C][C][=C][C][=C][Branch2][Ring1][P][N][C][C][C][Branch2][Ring1][=Branch1][C][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][N][=C][C][=N][Ring1][=Branch1][C][Ring1][=C][C][Ring2][Ring1][C][N][=N][Ring2][Ring1][Branch2] | N16CCC2(CCCN5C2)C1.Cc1ccc6nn1.c17cnccn1.C57=O |
1928541 | Cc1cnc(N2CCC3(CCCN(c4ncccn4)C3)C2)nc1 | [C][C][=C][N][=C][Branch2][Ring1][N][N][C][C][C][Branch2][Ring1][C][C][C][C][N][Branch1][=Branch2][C][=N][C][=C][C][=N][Ring1][=Branch1][C][Ring1][N][C][Ring1][S][N][=C][Ring2][Ring1][=Branch1] | N15CCC2(CCCN6C2)C1.Cc1cnc5nc1.c16ncccn1 |
1928542 | CCc1cnc(N2CCC3(CCCN(c4ncccn4)C3)C2)nc1 | [C][C][C][=C][N][=C][Branch2][Ring1][N][N][C][C][C][Branch2][Ring1][C][C][C][C][N][Branch1][=Branch2][C][=N][C][=C][C][=N][Ring1][=Branch1][C][Ring1][N][C][Ring1][S][N][=C][Ring2][Ring1][=Branch1] | N15CCC2(CCCN6C2)C1.c17cnc5nc1.c16ncccn1.CC7 |
1928543 | O=C(N1CCOCC1)N1CCC2(CCCN(c3ncccn3)C2)C1 | [O][=C][Branch1][=Branch2][N][C][C][O][C][C][Ring1][=Branch1][N][C][C][C][Branch2][Ring1][C][C][C][C][N][Branch1][=Branch2][C][=N][C][=C][C][=N][Ring1][=Branch1][C][Ring1][N][C][Ring1][S] | N15CCC2(CCCN6C2)C1.N14CCOCC1.c16ncccn1.O=C45 |
1928544 | Fc1cnc(N2CCCC3(CCN(c4ncccn4)C3)C2)nc1 | [F][C][=C][N][=C][Branch2][Ring1][O][N][C][C][C][C][Branch1][P][C][C][N][Branch1][=Branch2][C][=N][C][=C][C][=N][Ring1][=Branch1][C][Ring1][O][C][Ring1][S][N][=C][Ring2][Ring1][=Branch1] | N15CCCC2(CCN6C2)C1.Fc1cnc5nc1.c16ncccn1 |
1928545 | Fc1cnc(N2CCCC3(CCN(c4ncc(F)cn4)C3)C2)nc1 | [F][C][=C][N][=C][Branch2][Ring1][#C][N][C][C][C][C][Branch2][Ring1][Ring2][C][C][N][Branch1][N][C][=N][C][=C][Branch1][C][F][C][=N][Ring1][#Branch1][C][Ring1][N][C][Ring1][P][N][=C][Ring2][Ring1][#Branch1] | N15CCCC2(CCN6C2)C1.Fc1cnc5nc1.c16ncc(F)cn1 |
1928546 | Cc1cnc(N2CCC3(CCCN(c4ncc(F)cn4)C3)C2)nc1 | [C][C][=C][N][=C][Branch2][Ring1][#C][N][C][C][C][Branch2][Ring1][Branch1][C][C][C][N][Branch1][N][C][=N][C][=C][Branch1][C][F][C][=N][Ring1][#Branch1][C][Ring1][=N][C][Ring1][P][N][=C][Ring2][Ring1][#Branch1] | N15CCC2(CCCN6C2)C1.Cc1cnc5nc1.c16ncc(F)cn1 |
1928547 | CCc1cnc(N2CCC3(CCCN(c4ncc(F)cn4)C3)C2)nc1 | [C][C][C][=C][N][=C][Branch2][Ring1][#C][N][C][C][C][Branch2][Ring1][Branch1][C][C][C][N][Branch1][N][C][=N][C][=C][Branch1][C][F][C][=N][Ring1][#Branch1][C][Ring1][=N][C][Ring1][P][N][=C][Ring2][Ring1][#Branch1] | N15CCC2(CCCN6C2)C1.c17cnc5nc1.c16ncc(F)cn1.CC7 |
1928549 | NC(=O)N1CCC2(CC1)CCN(C(=O)c1cccs1)CC2 | [N][C][=Branch1][C][=O][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][C][N][Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][S][Ring1][Branch1][C][C][Ring1][#C] | N13CCC2(CC1)CCN4CC2.c15cccs1.NC3=O.C45=O |
1928550 | O=C(C1CC=CC1)N1CCC2(CC1)CCN(c1ncccn1)CC2 | [O][=C][Branch1][Branch2][C][C][C][=C][C][Ring1][Branch1][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][C][N][Branch1][=Branch2][C][=N][C][=C][C][=N][Ring1][=Branch1][C][C][Ring1][=C] | N13CCC2(CC1)CCN4CC2.c14ncccn1.C15CC=CC1.O=C35 |
1928551 | Cc1ccc(N2CCC3(CCN(C(N)=O)CC3)CC2)nn1 | [C][C][=C][C][=C][Branch2][Ring1][=Branch2][N][C][C][C][Branch1][#C][C][C][N][Branch1][=Branch1][C][Branch1][C][N][=O][C][C][Ring1][=Branch2][C][C][Ring1][=C][N][=N][Ring2][Ring1][Ring2] | N15CCC2(CCN4CC2)CC1.Cc1ccc5nn1.C4(N)=O |
1928552 | O=C(c1cccnc1)N1CCC2(CCCN(c3ncccn3)C2)CC1 | [O][=C][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][N][C][C][C][Branch2][Ring1][C][C][C][C][N][Branch1][=Branch2][C][=N][C][=C][C][=N][Ring1][=Branch1][C][Ring1][N][C][C][Ring1][P] | N14CCC2(CCCN5C2)CC1.c16cccnc1.c15ncccn1.O=C46 |
1928553 | O=C1CCCC2(CCN(C(=O)c3ccnnc3)CC2)N1 | [O][=C][C][C][C][C][Branch2][Ring1][=Branch1][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][C][=N][N][=C][Ring1][=Branch1][C][C][Ring1][=C][N][Ring2][Ring1][Ring1] | O=C1CCCC2(CCN4CC2)N1.c15ccnnc1.C45=O |
1928554 | CCOC1COC2(CCN(C(=O)Cc3cccc(F)c3)CC2)C1 | [C][C][O][C][C][O][C][Branch2][Ring1][#Branch2][C][C][N][Branch1][P][C][=Branch1][C][=O][C][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][C][Ring1][S][C][Ring2][Ring1][Ring2] | C16COC2(CCN4CC2)C1.c17cccc(F)c1.C4(=O)C7.CC5.O56 |
1928556 | COC1COC2(CCN(C(=O)Cc3cccc(F)c3)CC2)C1 | [C][O][C][C][O][C][Branch2][Ring1][#Branch2][C][C][N][Branch1][P][C][=Branch1][C][=O][C][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][C][Ring1][S][C][Ring2][Ring1][Ring2] | C15COC2(CCN4CC2)C1.c16cccc(F)c1.C4(=O)C6.CO5 |
1928557 | COc1ccc(CC(=O)N2CCC3(CC2)CC(OC)CO3)cc1 | [C][O][C][=C][C][=C][Branch2][Ring1][#Branch2][C][C][=Branch1][C][=O][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][C][Branch1][Ring1][O][C][C][O][Ring1][=Branch2][C][=C][Ring2][Ring1][Branch1] | N14CCC2(CC1)CC5CO2.c16ccc7cc1.C7C4=O.CO6.O5C |
1928558 | c1ccc(CN2CCOC3(CCN(c4ncccn4)CC3)C2)cc1 | [C][=C][C][=C][Branch2][Ring1][=C][C][N][C][C][O][C][Branch2][Ring1][C][C][C][N][Branch1][=Branch2][C][=N][C][=C][C][=N][Ring1][=Branch1][C][C][Ring1][N][C][Ring1][P][C][=C][Ring2][Ring1][Branch2] | N15CCOC2(CCN6CC2)C1.c1ccc7cc1.c16ncccn1.C57 |
1928559 | NC(=O)N1CCC2(CC1)CN(C(=O)c1cscn1)CCO2 | [N][C][=Branch1][C][=O][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][N][Branch1][N][C][=Branch1][C][=O][C][=C][S][C][=N][Ring1][Branch1][C][C][O][Ring1][#C] | N13CCC2(CC1)CN4CCO2.c15cscn1.NC3=O.C45=O |
1928560 | O=C(c1cccnc1)N1CCOC2(CCN(c3ncccn3)CC2)C1 | [O][=C][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][N][C][C][O][C][Branch2][Ring1][C][C][C][N][Branch1][=Branch2][C][=N][C][=C][C][=N][Ring1][=Branch1][C][C][Ring1][N][C][Ring1][P] | N14CCOC2(CCN5CC2)C1.c16cccnc1.c15ncccn1.O=C46 |
1928561 | O=C(C1CCCO1)N1CCC2(CC1)CN(c1ncccn1)CCO2 | [O][=C][Branch1][Branch2][C][C][C][C][O][Ring1][Branch1][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][N][Branch1][=Branch2][C][=N][C][=C][C][=N][Ring1][=Branch1][C][C][O][Ring1][=C] | N13CCC2(CC1)CN4CCO2.c14ncccn1.C15CCCO1.O=C35 |
1928562 | O=S(=O)(C1CC1)N1CCC2(CC1)CN(c1ncccn1)CCO2 | [O][=S][=Branch1][C][=O][Branch1][=Branch1][C][C][C][Ring1][Ring1][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][N][Branch1][=Branch2][C][=N][C][=C][C][=N][Ring1][=Branch1][C][C][O][Ring1][=C] | N13CCC2(CC1)CN4CCO2.O=S3(=O)C1CC1.c14ncccn1 |
1928563 | CCOC1CC2(CCN(C(=O)c3ccc(F)cc3)CC2)C1 | [C][C][O][C][C][C][Branch2][Ring1][=Branch2][C][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][C][Ring1][#C][C][Ring2][Ring1][C] | C16CC2(CCN4CC2)C1.c17ccc(F)cc1.C47=O.CC5.O56 |
1928564 | CCOC1CC2(CCN(C(=O)c3cccc(F)c3)CC2)C1 | [C][C][O][C][C][C][Branch2][Ring1][=Branch2][C][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][C][Ring1][#C][C][Ring2][Ring1][C] | C16CC2(CCN4CC2)C1.c17cccc(F)c1.C47=O.CC5.O56 |
1928565 | CC(C)COC1CC2(CCN(C(=O)c3ccc(F)cc3)CC2)C1 | [C][C][Branch1][C][C][C][O][C][C][C][Branch2][Ring1][=Branch2][C][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][C][Ring1][#C][C][Ring2][Ring1][C] | C16CC2(CCN4CC2)C1.c17ccc(F)cc1.CC(C)C5.C47=O.O56 |
1928566 | CC(C)COC1CC2(CCN(C(=O)c3cccc(F)c3)CC2)C1 | [C][C][Branch1][C][C][C][O][C][C][C][Branch2][Ring1][=Branch2][C][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][C][Ring1][#C][C][Ring2][Ring1][C] | C16CC2(CCN4CC2)C1.c17cccc(F)c1.CC(C)C5.C47=O.O56 |
1928567 | COC1CC2(CCN(C(=O)c3ccc(F)cc3)CC2)C1 | [C][O][C][C][C][Branch2][Ring1][=Branch2][C][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][C][Ring1][#C][C][Ring2][Ring1][C] | C15CC2(CCN4CC2)C1.c16ccc(F)cc1.C46=O.CO5 |
1928568 | COC1CC2(CCN(C(=O)c3cccc(F)c3)CC2)C1 | [C][O][C][C][C][Branch2][Ring1][=Branch2][C][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][C][Ring1][#C][C][Ring2][Ring1][C] | C15CC2(CCN4CC2)C1.c16cccc(F)c1.C46=O.CO5 |
1928569 | COC1CC2(CCN(C(=O)c3cccc(Cl)c3)CC2)C1 | [C][O][C][C][C][Branch2][Ring1][=Branch2][C][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][C][C][Ring1][#C][C][Ring2][Ring1][C] | C15CC2(CCN4CC2)C1.c16cccc(Cl)c1.C46=O.CO5 |
1928573 | O=C(c1ccsc1)N1CCC2(CCN(Cc3ccccn3)C2=O)C1 | [O][=C][Branch1][Branch2][C][C][=C][S][C][=Ring1][Branch1][N][C][C][C][Branch2][Ring1][Ring1][C][C][N][Branch1][#Branch2][C][C][=C][C][=C][C][=N][Ring1][=Branch1][C][Ring1][N][=O][C][Ring1][P] | N14CCC2(CCN6C2=O)C1.c17ccccn1.c15ccsc1.O=C45.C67 |
1928574 | O=C(C1CCCO1)N1CCC2(CCN(c3ccsc3)C2=O)C1 | [O][=C][Branch1][Branch2][C][C][C][C][O][Ring1][Branch1][N][C][C][C][Branch1][P][C][C][N][Branch1][Branch2][C][C][=C][S][C][=Ring1][Branch1][C][Ring1][#Branch2][=O][C][Ring1][#C] | N14CCC2(CCN6C2=O)C1.C15CCCO1.c16ccsc1.O=C45 |
1928575 | Cn1cc(N2CCC3(CCN(C(=O)c4ccco4)C3)C2=O)cn1 | [C][N][C][=C][Branch2][Ring1][#C][N][C][C][C][Branch2][Ring1][Ring2][C][C][N][Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][O][Ring1][Branch1][C][Ring1][N][C][Ring1][S][=O][C][=N][Ring2][Ring1][=Branch1] | N17CCC2(CCN5C2)C1=O.Cn1cc7cn1.c16ccco1.C56=O |
1928576 | Cn1cc(N2CCC3(CCN(C(=O)c4cccnc4)C3)C2=O)cn1 | [C][N][C][=C][Branch2][Ring1][S][N][C][C][C][Branch2][Ring1][Branch1][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][C][=C][N][=C][Ring1][=Branch1][C][Ring1][=N][C][Ring1][P][=O][C][=N][Ring2][Ring1][#Branch1] | N17CCC2(CCN5C2)C1=O.Cn1cc7cn1.c16cccnc1.C56=O |
1928577 | Cc1ccc(C(=O)N2CCC3(CCN(c4cnn(C)c4)C3=O)C2)cn1 | [C][C][=C][C][=C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][Ring2][C][C][N][Branch1][O][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][C][Ring1][O][=O][C][Ring1][S][C][=N][Ring2][Ring1][Branch2] | N15CCC2(CCN7C2=O)C1.Cc1ccc6cn1.c17cnn(C)c1.C56=O |
1928578 | Cc1ccc(-c2ccc(C(=O)N(C)C)cc2)c(-n2cccn2)c1 | [C][C][=C][C][=C][Branch2][Ring1][Ring2][C][=C][C][=C][Branch1][#Branch2][C][=Branch1][C][=O][N][Branch1][C][C][C][C][=C][Ring1][O][C][Branch1][Branch2][N][C][=C][C][=N][Ring1][Branch1][=C][Ring2][Ring1][=Branch1] | Cc1ccc6c5c1.c16ccc4cc1.n15cccn1.C34=O.N3(C)C |
1928579 | CNc1ncc(C(=O)NC(CO)Cc2c[nH]c3ccccc23)cn1 | [C][N][C][=N][C][=C][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][N][C][Branch1][Ring1][C][O][C][C][=C][NH1][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1][C][=N][Ring2][Ring1][=Branch1] | c18c[nH]c2ccccc12.c16ncc7cn1.C5(C8)CO.C47=O.CN6.N45 |
1928580 | Cn1nccc1-c1cccc(-c2ccc(CC(N)=O)cc2)c1 | [C][N][N][=C][C][=C][Ring1][Branch1][C][=C][C][=C][C][Branch1][P][C][=C][C][=C][Branch1][#Branch1][C][C][Branch1][C][N][=O][C][=C][Ring1][#Branch2][=C][Ring1][S] | c14cccc5c1.c15ccc3cc1.Cn1nccc14.C3C(N)=O |
1928582 | COCC1CCCC12CN(S(=O)(=O)c1cccs1)CCO2 | [C][O][C][C][C][C][C][C][Ring1][Branch1][C][N][Branch1][#C][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][S][Ring1][Branch1][C][C][O][Ring1][=C] | C15CCCC12CN4CCO2.S4(=O)(=O)c1cccs1.CO3.C35 |
1928583 | C=CCOCC1CCCC12CN(C(=O)c1cccc(C#N)c1)CCO2 | [C][=C][C][O][C][C][C][C][C][C][Ring1][Branch1][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][Ring1][C][#N][=C][Ring1][Branch2][C][C][O][Ring1][S] | C17CCCC12CN3CCO2.c16cccc(C#N)c1.C=CC4.C36=O.O45.C57 |
1928584 | C=CCOCC1CCCC12CN(C(=O)c1ccc(C#N)cc1)CCO2 | [C][=C][C][O][C][C][C][C][C][C][Ring1][Branch1][C][N][Branch1][P][C][=Branch1][C][=O][C][=C][C][=C][Branch1][Ring1][C][#N][C][=C][Ring1][Branch2][C][C][O][Ring1][S] | C17CCCC12CN3CCO2.c16ccc(C#N)cc1.C=CC4.C36=O.O45.C57 |
1928585 | CCC(CC)n1ncc(C)c1NC(=O)NC1CCCNC1=O | [C][C][C][Branch1][Ring1][C][C][N][N][=C][C][Branch1][C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][N][C][C][C][C][N][C][Ring1][=Branch1][=O] | n16ncc(C)c14.C15CCCNC1=O.CCC6CC.C23=O.N24.N35 |
1928586 | c1cnc(N2CCOC3(CCCC3COc3cccnc3)C2)nc1 | [C][=C][N][=C][Branch2][Ring1][N][N][C][C][O][C][Branch1][P][C][C][C][C][Ring1][Branch1][C][O][C][=C][C][=C][N][=C][Ring1][=Branch1][C][Ring2][Ring1][C][N][=C][Ring2][Ring1][Branch2] | N16CCOC2(CCCC27)C1.c1cnc6nc1.c15cccnc1.C47.O45 |
1928587 | Cc1cnc(N2CCOC3(CCCC3COc3cccnc3)C2)nc1 | [C][C][=C][N][=C][Branch2][Ring1][N][N][C][C][O][C][Branch1][P][C][C][C][C][Ring1][Branch1][C][O][C][=C][C][=C][N][=C][Ring1][=Branch1][C][Ring2][Ring1][C][N][=C][Ring2][Ring1][Branch2] | N16CCOC2(CCCC27)C1.Cc1cnc6nc1.c15cccnc1.C47.O45 |
1928589 | CC(C)OCC1CCCC12CN(C(=O)c1ccccc1F)CCO2 | [C][C][Branch1][C][C][O][C][C][C][C][C][C][Ring1][Branch1][C][N][Branch1][=C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][F][C][C][O][Ring1][#C] | C17CCCC12CN3CCO2.c16ccccc1F.CC4C.C36=O.O45.C57 |
1928590 | CC(=O)c1cc(C(=O)NCCCn2nnc3ccccc32)cs1 | [C][C][=Branch1][C][=O][C][=C][C][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C][N][N][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][=Branch2][=C][S][Ring2][Ring1][Ring2] | n18nnc2ccccc21.c16cc7cs1.C5CC8.CC6=O.C47=O.N45 |
1928591 | CCc1nc(C)c(-c2nc(CC3CC3)nn2CC)s1 | [C][C][C][=N][C][Branch1][C][C][=C][Branch2][Ring1][C][C][=N][C][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][=N][N][Ring1][=Branch2][C][C][S][Ring1][P] | c15nc(C)c8s1.c18nc6nn14.C17CC1.CC5.C67.C4C |
1928592 | c1csc(CN2CCOCC3(CCC(Cn4cccn4)O3)C2)c1 | [C][=C][S][C][Branch2][Ring1][=N][C][N][C][C][O][C][C][Branch1][P][C][C][C][Branch1][=Branch2][C][N][C][=C][C][=N][Ring1][Branch1][O][Ring1][O][C][Ring1][P][=C][Ring2][Ring1][#Branch1] | N15CCOCC2(CCC7O2)C1.c1csc8c1.n16cccn1.C58.C67 |
1928593 | c1cnn(CC2CCC3(COCCN(Cc4nccs4)C3)O2)c1 | [C][C][=N][N][Branch2][Ring1][=C][C][C][C][C][C][Branch2][Ring1][Ring1][C][O][C][C][N][Branch1][=Branch2][C][C][=N][C][=C][S][Ring1][Branch1][C][Ring1][=N][O][Ring1][P][C][=Ring2][Ring1][#Branch1] | C17CCC2(COCCN5C2)O1.c1cnn6c1.c18nccs1.C67.C58 |
1928594 | Cc1ccc(CN2CCOCC3(CCC(Cn4cccn4)O3)C2)s1 | [C][C][=C][C][=C][Branch2][Ring1][=N][C][N][C][C][O][C][C][Branch1][P][C][C][C][Branch1][=Branch2][C][N][C][=C][C][=N][Ring1][Branch1][O][Ring1][O][C][Ring1][P][S][Ring2][Ring1][#Branch1] | N15CCOCC2(CCC7O2)C1.Cc1ccc8s1.n16cccn1.C58.C67 |
1928595 | O=C(c1ccco1)N1CCOCC2(CCC(Cn3cccn3)O2)C1 | [O][=C][Branch1][Branch2][C][=C][C][=C][O][Ring1][Branch1][N][C][C][O][C][C][Branch1][P][C][C][C][Branch1][=Branch2][C][N][C][=C][C][=N][Ring1][Branch1][O][Ring1][O][C][Ring1][P] | N14CCOCC2(CCC7O2)C1.c15ccco1.n16cccn1.O=C45.C67 |
1928596 | O=C(c1ccnnc1)N1CCOCC2(CCC(Cn3cccn3)O2)C1 | [O][=C][Branch1][=Branch2][C][=C][C][=N][N][=C][Ring1][=Branch1][N][C][C][O][C][C][Branch1][P][C][C][C][Branch1][=Branch2][C][N][C][=C][C][=N][Ring1][Branch1][O][Ring1][O][C][Ring1][P] | N14CCOCC2(CCC7O2)C1.c15ccnnc1.n16cccn1.O=C45.C67 |
1928597 | Cc1ccoc1C(=O)N1CCOCC2(CCC(Cn3cccn3)O2)C1 | [C][C][C][=C][O][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C][O][C][C][Branch1][P][C][C][C][Branch1][=Branch2][C][N][C][=C][C][=N][Ring1][Branch1][O][Ring1][O][C][Ring1][P] | N14CCOCC2(CCC7O2)C1.Cc1ccoc15.n16cccn1.C45=O.C67 |
1928598 | Cc1ccc(C(=O)N2CCOCC3(CCC(Cn4cccn4)O3)C2)o1 | [C][C][=C][C][=C][Branch2][Ring1][S][C][=Branch1][C][=O][N][C][C][O][C][C][Branch1][P][C][C][C][Branch1][=Branch2][C][N][C][=C][C][=N][Ring1][Branch1][O][Ring1][O][C][Ring1][P][O][Ring2][Ring1][Branch2] | N15CCOCC2(CCC8O2)C1.Cc1ccc6o1.n17cccn1.C56=O.C78 |
1928599 | Cc1cc(-c2ccc(S(C)(=O)=O)cc2)c(=O)[nH]c1C | [C][C][C][=C][Branch2][Ring1][Ring1][C][=C][C][=C][Branch1][=Branch2][S][Branch1][C][C][=Branch1][C][=O][=O][C][=C][Ring1][#Branch2][C][=Branch1][C][=O][NH1][C][=Ring1][P][C] | c13ccc(S(C)(=O)=O)cc1.Cc1cc3c(=O)[nH]c1C |
1928600 | c1ncn(CC2CCC3(COCCN(Cc4ccsc4)C3)O2)n1 | [C][N][=C][N][Branch2][Ring1][=C][C][C][C][C][C][Branch2][Ring1][Ring1][C][O][C][C][N][Branch1][=Branch2][C][C][C][=C][S][C][=Ring1][Branch1][C][Ring1][=N][O][Ring1][P][N][=Ring2][Ring1][#Branch1] | C17CCC2(COCCN5C2)O1.c1ncn6n1.c18ccsc1.C67.C58 |
1928601 | Fc1cnc(N2CCOCC3(CCC(Cn4cncn4)O3)C2)nc1 | [F][C][=C][N][=C][Branch2][Ring1][N][N][C][C][O][C][C][Branch1][P][C][C][C][Branch1][=Branch2][C][N][C][=N][C][=N][Ring1][Branch1][O][Ring1][O][C][Ring1][P][N][=C][Ring2][Ring1][#Branch1] | N15CCOCC2(CCC7O2)C1.Fc1cnc5nc1.n16cncn1.C67 |
1928602 | Cc1cnc(N2CCOCC3(CCC(Cn4cncn4)O3)C2)nc1 | [C][C][=C][N][=C][Branch2][Ring1][N][N][C][C][O][C][C][Branch1][P][C][C][C][Branch1][=Branch2][C][N][C][=N][C][=N][Ring1][Branch1][O][Ring1][O][C][Ring1][P][N][=C][Ring2][Ring1][#Branch1] | N15CCOCC2(CCC7O2)C1.Cc1cnc5nc1.n16cncn1.C67 |
1928603 | COc1cc(-c2ccccc2C(=O)N(C)C)c(Cl)cn1 | [C][O][C][=C][C][Branch2][Ring1][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Branch1][C][C][C][=C][Branch1][C][Cl][C][=N][Ring2][Ring1][C] | c14cc6c(Cl)cn1.c16ccccc15.C35=O.N3(C)C.CO4 |
1928604 | CCc1nnc(CN(C)C(=O)Nc2cccc3cc(C)oc23)o1 | [C][C][C][=N][N][=C][Branch2][Ring1][O][C][N][Branch1][C][C][C][=Branch1][C][=O][N][C][=C][C][=C][C][C][=C][Branch1][C][C][O][C][Ring1][#Branch2][=Ring1][=Branch1][O][Ring2][Ring1][Branch1] | c17cccc2cc(C)oc12.c18nnc9o1.N46C.C45=O.CC8.C69.N57 |
1928605 | Cc1ncc(C(=O)NCc2csc(N3CCOCC3)n2)c(=O)[nH]1 | [C][C][=N][C][=C][Branch2][Ring1][Branch2][C][=Branch1][C][=O][N][C][C][=C][S][C][Branch1][=Branch2][N][C][C][O][C][C][Ring1][=Branch1][=N][Ring1][O][C][=Branch1][C][=O][NH1][Ring2][Ring1][=Branch1] | Cc1ncc7c(=O)[nH]1.c18csc6n1.N16CCOCC1.C47=O.N45.C58 |
1928606 | CCCn1cc(-c2nc(CCOC)no2)c(C)n1 | [C][C][C][N][C][=C][Branch1][=C][C][=N][C][Branch1][Branch1][C][C][O][C][=N][O][Ring1][=Branch2][C][Branch1][C][C][=N][Ring1][#C] | n14cc6c(C)n1.c16nc5no1.CCC4.C5C3.O3C |
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