ID large_stringlengths 1 7 | smiles stringlengths 15 57 | selfies stringlengths 55 294 | safe stringlengths 15 83 |
|---|---|---|---|
1929608 | COc1ccc2c(c1)CC(=O)c1ccccc1S2 | [C][O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][S][Ring1][=N] | c13ccc2c(c1)CC(=O)c1ccccc1S2.CO3 |
1929609 | O=C(NCCc1cccnc1)C1COC(=O)N1CC1CCCCC1 | [O][=C][Branch1][N][N][C][C][C][=C][C][=C][N][=C][Ring1][=Branch1][C][C][O][C][=Branch1][C][=O][N][Ring1][=Branch1][C][C][C][C][C][C][C][Ring1][=Branch1] | C14COC(=O)N15.c17cccnc1.C16CCCCC1.O=C24.C3C7.N23.C56 |
1929610 | CN1CC(=O)N(c2ccsc2)CC12CCN(S(C)(=O)=O)C2 | [C][N][C][C][=Branch1][C][=O][N][Branch1][Branch2][C][C][=C][S][C][=Ring1][Branch1][C][C][Ring1][N][C][C][N][Branch1][=Branch2][S][Branch1][C][C][=Branch1][C][=O][=O][C][Ring1][=Branch2] | CN1CC(=O)N4CC12CCN3C2.c14ccsc1.S3(C)(=O)=O |
1929611 | CCS(=O)(=O)N1CCC2(CN(c3ccsc3)C(=O)CN2C)C1 | [C][C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][Branch1][C][N][Branch1][Branch2][C][C][=C][S][C][=Ring1][Branch1][C][=Branch1][C][=O][C][N][Ring1][N][C][C][Ring1][P] | N14CCC2(C1)CN5C(=O)CN2C.CCS4(=O)=O.c15ccsc1 |
1929612 | CC(C)NC(=O)N1CCC2(C1)CN(c1ccsc1)C(=O)CN2C | [C][C][Branch1][C][C][N][C][=Branch1][C][=O][N][C][C][C][Branch1][Ring2][C][Ring1][Branch1][C][N][Branch1][Branch2][C][C][=C][S][C][=Ring1][Branch1][C][=Branch1][C][=O][C][N][Ring1][=N][C] | N14CCC2(C1)CN6C(=O)CN2C.c16ccsc1.CC5C.C34=O.N35 |
1929613 | CN1CC(=O)N(c2ccccc2)CC12CCN(C(=O)CC1CC1)C2 | [C][N][C][C][=Branch1][C][=O][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][=N][C][C][N][Branch1][O][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring1][C][Ring1][O] | CN1CC(=O)N5CC12CCN3C2.c15ccccc1.C3(=O)C4.C14CC1 |
1929614 | CC(C)C(=O)N1CCC2(C1)CN(c1ccsc1)C(=O)CN2C | [C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][Branch1][Ring2][C][Ring1][Branch1][C][N][Branch1][Branch2][C][C][=C][S][C][=Ring1][Branch1][C][=Branch1][C][=O][C][N][Ring1][=N][C] | N13CCC2(C1)CN4C(=O)CN2C.CC(C)C3=O.c14ccsc1 |
1929615 | CCC(=O)N1CCC2(C1)CN(c1ccsc1)C(=O)CN2C | [C][C][C][=Branch1][C][=O][N][C][C][C][Branch1][Ring2][C][Ring1][Branch1][C][N][Branch1][Branch2][C][C][=C][S][C][=Ring1][Branch1][C][=Branch1][C][=O][C][N][Ring1][=N][C] | N13CCC2(C1)CN4C(=O)CN2C.c14ccsc1.CCC3=O |
1929616 | CC(C)CC(=O)N1CCC2(C1)CN(c1ccsc1)C(=O)CN2C | [C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][C][Branch1][Ring2][C][Ring1][Branch1][C][N][Branch1][Branch2][C][C][=C][S][C][=Ring1][Branch1][C][=Branch1][C][=O][C][N][Ring1][=N][C] | N13CCC2(C1)CN4C(=O)CN2C.CC(C)CC3=O.c14ccsc1 |
1929618 | CN(C)C(=O)N1CCC2(C1)CN(c1ccsc1)C(=O)CN2C | [C][N][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][Branch1][Ring2][C][Ring1][Branch1][C][N][Branch1][Branch2][C][C][=C][S][C][=Ring1][Branch1][C][=Branch1][C][=O][C][N][Ring1][=N][C] | N14CCC2(C1)CN5C(=O)CN2C.c15ccsc1.CN3C.C34=O |
1929619 | CCN1CC(=O)NCC12CCN(C(=O)Nc1ccccc1)C2 | [C][C][N][C][C][=Branch1][C][=O][N][C][C][Ring1][#Branch1][C][C][N][Branch1][=C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][=C] | N15CC(=O)NCC12CCN3C2.c16ccccc1.C34=O.CC5.N46 |
1929620 | Cc1ccc(C(=O)N2CCC3(CNC(=O)CN3CC3CC3)C2)cn1 | [C][C][=C][C][=C][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C][C][Branch1][P][C][N][C][=Branch1][C][=O][C][N][Ring1][#Branch1][C][C][C][C][Ring1][Ring1][C][Ring1][#C][C][=N][Ring2][Ring1][#Branch1] | N14CCC2(CNC(=O)CN25)C1.Cc1ccc6cn1.C46=O.C17CC1.C57 |
1929621 | CC(=O)N1CC(=O)NCC12CCN(C(=O)c1ccc(C)nc1)C2 | [C][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C][Ring1][#Branch1][C][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][C][N][=C][Ring1][#Branch1][C][Ring1][=C] | N13CC(=O)NCC12CCN4C2.c15ccc(C)nc1.CC3=O.C45=O |
1929622 | CN(C)C(=O)N1CC(=O)NCC12CCN(C(=O)Nc1ccccc1)C2 | [C][N][Branch1][C][C][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C][Ring1][#Branch1][C][C][N][Branch1][=C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][=C] | N14CC(=O)NCC12CCN5C2.c17ccccc1.CN3C.C34=O.C56=O.N67 |
1929623 | Cc1cnc(N2CCC3(CC2)CC3CNC(=O)N(C)C)nc1 | [C][C][=C][N][=C][Branch2][Ring1][#Branch2][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][C][Ring1][Branch1][C][N][C][=Branch1][C][=O][N][Branch1][C][C][C][N][=C][Ring2][Ring1][Branch1] | N17CCC2(CC1)CC28.Cc1cnc7nc1.C45=O.N5(C)C.C68.N46 |
1929624 | CN(C)C(=O)NCC1CC12CCN(C(=O)c1ccno1)CC2 | [C][N][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][C][Ring1][Ring1][C][C][N][Branch1][N][C][=Branch1][C][=O][C][=C][C][=N][O][Ring1][Branch1][C][C][Ring1][=N] | C18CC12CCN5CC2.c17ccno1.CN3C.C34=O.C57=O.N46.C68 |
1929625 | CS(=O)(=O)NCC1CC12CCN(c1ncccn1)CC2 | [C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][C][Ring1][Ring1][C][C][N][Branch1][=Branch2][C][=N][C][=C][C][=N][Ring1][=Branch1][C][C][Ring1][N] | C16CC12CCN5CC2.c15ncccn1.CS4(=O)=O.N34.C36 |
1929626 | CS(=O)(=O)NCC1CC12CCN(C(=O)c1ccno1)CC2 | [C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][C][Ring1][Ring1][C][C][N][Branch1][N][C][=Branch1][C][=O][C][=C][C][=N][O][Ring1][Branch1][C][C][Ring1][=N] | C17CC12CCN3CC2.c16ccno1.CS5(=O)=O.C36=O.N45.C47 |
1929627 | O=C(c1ccnnc1)N1CCC2(CC(=O)N(c3ccccc3)C2)C1 | [O][=C][Branch1][=Branch2][C][=C][C][=N][N][=C][Ring1][=Branch1][N][C][C][C][Branch2][Ring1][Ring2][C][C][=Branch1][C][=O][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][N][C][Ring1][S] | N14CCC2(CC(=O)N6C2)C1.c15ccnnc1.c16ccccc1.O=C45 |
1929628 | O=C(C1CC=CC1)N1CCC2(CC(=O)N(c3ccccc3)C2)C1 | [O][=C][Branch1][Branch2][C][C][C][=C][C][Ring1][Branch1][N][C][C][C][Branch2][Ring1][Ring2][C][C][=Branch1][C][=O][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][N][C][Ring1][S] | N14CCC2(CC(=O)N6C2)C1.c16ccccc1.C15CC=CC1.O=C45 |
1929629 | Cc1ccc(N2CC3(CCN(C(=O)c4ccnnc4)C3)CC2=O)cc1 | [C][C][=C][C][=C][Branch2][Ring1][S][N][C][C][Branch2][Ring1][Branch1][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][C][=N][N][=C][Ring1][=Branch1][C][Ring1][=N][C][C][Ring1][P][=O][C][=C][Ring2][Ring1][Branch2] | N17CC2(CCN5C2)CC1=O.Cc1ccc7cc1.c16ccnnc1.C56=O |
1929630 | O=C(c1ccnnc1)N1CCC2(CC(=O)N(c3cccc(F)c3)C2)C1 | [O][=C][Branch1][=Branch2][C][=C][C][=N][N][=C][Ring1][=Branch1][N][C][C][C][Branch2][Ring1][#Branch1][C][C][=Branch1][C][=O][N][Branch1][N][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][Ring1][=N][C][Ring1][P] | N14CCC2(CC(=O)N6C2)C1.c16cccc(F)c1.c15ccnnc1.O=C45 |
1929631 | O=C(C1CC=CC1)N1CCC2(CC(=O)N(c3ccc(F)cc3)C2)C1 | [O][=C][Branch1][Branch2][C][C][C][=C][C][Ring1][Branch1][N][C][C][C][Branch2][Ring1][#Branch1][C][C][=Branch1][C][=O][N][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][Ring1][=N][C][Ring1][P] | N14CCC2(CC(=O)N6C2)C1.c16ccc(F)cc1.C15CC=CC1.O=C45 |
1929633 | N#Cc1cccc(N2CC3(CCN(C(=O)c4ccnnc4)C3)CC2=O)c1 | [N][#C][C][=C][C][=C][C][Branch2][Ring1][S][N][C][C][Branch2][Ring1][Branch1][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][C][=N][N][=C][Ring1][=Branch1][C][Ring1][=N][C][C][Ring1][P][=O][=C][Ring2][Ring1][Branch2] | N17CC2(CCN5C2)CC1=O.N#Cc1cccc7c1.c16ccnnc1.C56=O |
1929634 | COc1cccc(N2CC3(CCN(C(=O)C4CC=CC4)C3)CC2=O)c1 | [C][O][C][=C][C][=C][C][Branch2][Ring1][#C][N][C][C][Branch2][Ring1][Ring2][C][C][N][Branch1][N][C][=Branch1][C][=O][C][C][C][=C][C][Ring1][Branch1][C][Ring1][N][C][C][Ring1][S][=O][=C][Ring2][Ring1][#Branch1] | N18CC2(CCN5C2)CC1=O.c16cccc8c1.C17CC=CC1.C57=O.CO6 |
1929635 | COc1ccc(N2CC3(CCN(C(=O)C4CC=CC4)C3)CC2=O)cc1 | [C][O][C][=C][C][=C][Branch2][Ring1][#C][N][C][C][Branch2][Ring1][Ring2][C][C][N][Branch1][N][C][=Branch1][C][=O][C][C][C][=C][C][Ring1][Branch1][C][Ring1][N][C][C][Ring1][S][=O][C][=C][Ring2][Ring1][#Branch1] | N18CC2(CCN5C2)CC1=O.c16ccc8cc1.C17CC=CC1.C57=O.CO6 |
1929636 | O=C(C1CC=CC1)N1CCC2(CC(=O)N(c3ccc(F)c(F)c3)C2)C1 | [O][=C][Branch1][Branch2][C][C][C][=C][C][Ring1][Branch1][N][C][C][C][Branch2][Ring1][#Branch2][C][C][=Branch1][C][=O][N][Branch1][#C][C][=C][C][=C][Branch1][C][F][C][Branch1][C][F][=C][Ring1][Branch2][C][Ring1][=C][C][Ring2][Ring1][C] | N14CCC2(CC(=O)N6C2)C1.c16ccc(F)c(F)c1.C15CC=CC1.O=C45 |
1929637 | O=C1CC2(CCN(c3ncc(F)cn3)C2)CN1c1cccnc1 | [O][=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][N][Ring1][S][C][=C][C][=C][N][=C][Ring1][=Branch1] | O=C1CC2(CCN4C2)CN15.c14ncc(F)cn1.c15cccnc1 |
1929638 | Cc1cnc(N2CCC3(CC(=O)N(c4cccnc4)C3)C2)nc1 | [C][C][=C][N][=C][Branch2][Ring1][=C][N][C][C][C][Branch2][Ring1][Ring2][C][C][=Branch1][C][=O][N][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][C][Ring1][N][C][Ring1][S][N][=C][Ring2][Ring1][=Branch1] | N15CCC2(CC(=O)N6C2)C1.Cc1cnc5nc1.c16cccnc1 |
1929639 | CCc1cnc(N2CCC3(CC(=O)N(c4cccnc4)C3)C2)nc1 | [C][C][C][=C][N][=C][Branch2][Ring1][=C][N][C][C][C][Branch2][Ring1][Ring2][C][C][=Branch1][C][=O][N][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][C][Ring1][N][C][Ring1][S][N][=C][Ring2][Ring1][=Branch1] | N15CCC2(CC(=O)N7C2)C1.c16cnc5nc1.c17cccnc1.CC6 |
1929640 | O=C(C1CC1)N1CCC2(CC(=O)N(c3cccnc3)C2)C1 | [O][=C][Branch1][=Branch1][C][C][C][Ring1][Ring1][N][C][C][C][Branch2][Ring1][Ring2][C][C][=Branch1][C][=O][N][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][C][Ring1][N][C][Ring1][S] | N14CCC2(CC(=O)N6C2)C1.c16cccnc1.O=C45.C15CC1 |
1929641 | O=C(c1cccnc1)N1CCC2(CC(=O)N(c3ccccn3)C2)C1 | [O][=C][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][N][C][C][C][Branch2][Ring1][Ring2][C][C][=Branch1][C][=O][N][Branch1][=Branch2][C][=C][C][=C][C][=N][Ring1][=Branch1][C][Ring1][N][C][Ring1][S] | N14CCC2(CC(=O)N6C2)C1.c15cccnc1.c16ccccn1.O=C45 |
1929642 | O=C(c1cnccn1)N1CCC2(CC(=O)N(c3ccccn3)C2)C1 | [O][=C][Branch1][=Branch2][C][=C][N][=C][C][=N][Ring1][=Branch1][N][C][C][C][Branch2][Ring1][Ring2][C][C][=Branch1][C][=O][N][Branch1][=Branch2][C][=C][C][=C][C][=N][Ring1][=Branch1][C][Ring1][N][C][Ring1][S] | N14CCC2(CC(=O)N6C2)C1.c15cnccn1.c16ccccn1.O=C45 |
1929643 | O=C(Cc1ccccc1)N1CCC2(CC(=O)N(c3ccsc3)C2)C1 | [O][=C][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][C][Branch2][Ring1][Ring1][C][C][=Branch1][C][=O][N][Branch1][Branch2][C][C][=C][S][C][=Ring1][Branch1][C][Ring1][O][C][Ring1][#C] | N14CCC2(CC(=O)N6C2)C1.c15ccccc1.c16ccsc1.O=C4C5 |
1929644 | O=C(C1CCCC1)N1CCC2(CC(=O)N(c3ccsc3)C2)C1 | [O][=C][Branch1][Branch2][C][C][C][C][C][Ring1][Branch1][N][C][C][C][Branch2][Ring1][Ring1][C][C][=Branch1][C][=O][N][Branch1][Branch2][C][C][=C][S][C][=Ring1][Branch1][C][Ring1][O][C][Ring1][#C] | N14CCC2(CC(=O)N6C2)C1.C15CCCC1.c16ccsc1.O=C45 |
1929645 | O=C(c1ccncc1)N1CCC2(CC(=O)N(c3ccsc3)C2)C1 | [O][=C][Branch1][=Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][N][C][C][C][Branch2][Ring1][Ring1][C][C][=Branch1][C][=O][N][Branch1][Branch2][C][C][=C][S][C][=Ring1][Branch1][C][Ring1][O][C][Ring1][#C] | N14CCC2(CC(=O)N6C2)C1.c15ccncc1.c16ccsc1.O=C45 |
1929646 | CCS(=O)(=O)N1CCC2(CC(=O)N(c3cnn(C)c3)C2)C1 | [C][C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][=Branch1][C][C][=Branch1][C][=O][N][Branch1][O][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][C][Ring1][N][C][Ring1][S] | N14CCC2(CC(=O)N5C2)C1.c15cnn(C)c1.CCS4(=O)=O |
1929647 | CCCS(=O)(=O)N1CCC2(CC(=O)N(c3cnn(C)c3)C2)C1 | [C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][=Branch1][C][C][=Branch1][C][=O][N][Branch1][O][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][C][Ring1][N][C][Ring1][S] | N14CCC2(CC(=O)N5C2)C1.CCCS4(=O)=O.c15cnn(C)c1 |
1929648 | Cc1ccc(N2CC3(CCN(C(=O)C4CC4)C3)CC2=O)s1 | [C][C][=C][C][=C][Branch2][Ring1][=N][N][C][C][Branch2][Ring1][C][C][C][N][Branch1][#Branch2][C][=Branch1][C][=O][C][C][C][Ring1][Ring1][C][Ring1][#Branch2][C][C][Ring1][=C][=O][S][Ring2][Ring1][Ring2] | N17CC2(CCN5C2)CC1=O.Cc1ccc7s1.C56=O.C16CC1 |
1929649 | Cc1nc(CN2CC3(CCN(c4cnccn4)C3)CC2=O)cs1 | [C][C][=N][C][Branch2][Ring1][N][C][N][C][C][Branch1][P][C][C][N][Branch1][=Branch2][C][=C][N][=C][C][=N][Ring1][=Branch1][C][Ring1][O][C][C][Ring1][#C][=O][=C][S][Ring2][Ring1][=Branch1] | N16CC2(CCN5C2)CC1=O.Cc1nc7cs1.c15cnccn1.C67 |
1929650 | Cn1cc(N2CC3(CCN(C(=O)CO)C3)CC2=O)cn1 | [C][N][C][=C][Branch2][Ring1][=Branch2][N][C][C][Branch1][#C][C][C][N][Branch1][#Branch1][C][=Branch1][C][=O][C][O][C][Ring1][=Branch2][C][C][Ring1][=N][=O][C][=N][Ring2][Ring1][Ring1] | N15CC2(CCN4C2)CC1=O.Cn1cc5cn1.C4(=O)CO |
1929652 | O=C(NCC1CC1)C1CCC2(CN(c3nncs3)C2)O1 | [O][=C][Branch1][Branch2][N][C][C][C][C][Ring1][Ring1][C][C][C][C][Branch1][#C][C][N][Branch1][Branch2][C][=N][N][=C][S][Ring1][Branch1][C][Ring1][=Branch2][O][Ring1][=N] | C17CCC2(CN6C2)O1.c16nncs1.O=C47.C18CC1.N45.C58 |
1929653 | CCC(C)N(C)C(=O)C1CCC2(CN(C(=O)c3ccco3)C2)O1 | [C][C][C][Branch1][C][C][N][Branch1][C][C][C][=Branch1][C][=O][C][C][C][C][Branch2][Ring1][Ring1][C][N][Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][O][Ring1][Branch1][C][Ring1][O][O][Ring1][#C] | C17CCC2(CN5C2)O1.c18ccco1.CCC6C.N46C.C47=O.C58=O |
1929654 | O=C(NC1CCC1)C1CCC2(CN(C(=O)c3ccno3)C2)O1 | [O][=C][Branch1][Branch2][N][C][C][C][C][Ring1][Ring2][C][C][C][C][Branch2][Ring1][Ring1][C][N][Branch1][N][C][=Branch1][C][=O][C][=C][C][=N][O][Ring1][Branch1][C][Ring1][O][O][Ring1][#C] | C17CCC2(CN5C2)O1.c18ccno1.C16CCC1.O=C47.C58=O.N46 |
1929655 | O=C(Nc1cccc(F)c1)C1CCC2(CN(c3nncs3)C2)O1 | [O][=C][Branch1][=N][N][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][C][C][C][C][Branch1][#C][C][N][Branch1][Branch2][C][=N][N][=C][S][Ring1][Branch1][C][Ring1][=Branch2][O][Ring1][=N] | C17CCC2(CN5C2)O1.c16cccc(F)c1.c15nncs1.O=C47.N46 |
1929656 | FC1(F)CCN(Cc2ccccn2)CC12CCN(c1cccnc1)C2 | [F][C][Branch1][C][F][C][C][N][Branch1][#Branch2][C][C][=C][C][=C][C][=N][Ring1][=Branch1][C][C][Ring1][=C][C][C][N][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][C][Ring1][O] | FC1(F)CCN3CC12CCN4C2.c15ccccn1.c14cccnc1.C35 |
1929657 | O=C(C1CC1)N1CCC(F)(F)C2(CCN(c3ncccc3F)C2)C1 | [O][=C][Branch1][=Branch1][C][C][C][Ring1][Ring1][N][C][C][C][Branch1][C][F][Branch1][C][F][C][Branch2][Ring1][C][C][C][N][Branch1][#Branch2][C][=N][C][=C][C][=C][Ring1][=Branch1][F][C][Ring1][N][C][Ring2][Ring1][Ring1] | N14CCC(F)(F)C2(CCN5C2)C1.c15ncccc1F.O=C46.C16CC1 |
1929658 | FC1(F)CCN(CC2CC2)CC12CCN(c1ncccn1)C2 | [F][C][Branch1][C][F][C][C][N][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][C][C][Ring1][O][C][C][N][Branch1][=Branch2][C][=N][C][=C][C][=N][Ring1][=Branch1][C][Ring1][O] | FC1(F)CCN3CC12CCN4C2.c14ncccn1.C15CC1.C35 |
1929659 | FC1(F)CCN(Cc2cccnc2)CC12CCN(c1cnccn1)C2 | [F][C][Branch1][C][F][C][C][N][Branch1][#Branch2][C][C][=C][C][=C][N][=C][Ring1][=Branch1][C][C][Ring1][=C][C][C][N][Branch1][=Branch2][C][=C][N][=C][C][=N][Ring1][=Branch1][C][Ring1][O] | FC1(F)CCN3CC12CCN4C2.c15cccnc1.c14cnccn1.C35 |
1929660 | O=C(C1CC1)N1CCC(F)(F)C2(CCN(c3cnccn3)C2)C1 | [O][=C][Branch1][=Branch1][C][C][C][Ring1][Ring1][N][C][C][C][Branch1][C][F][Branch1][C][F][C][Branch1][P][C][C][N][Branch1][=Branch2][C][=C][N][=C][C][=N][Ring1][=Branch1][C][Ring1][O][C][Ring2][Ring1][C] | N14CCC(F)(F)C2(CCN5C2)C1.c15cnccn1.O=C46.C16CC1 |
1929662 | CS(=O)(=O)N1CCCCC12CCN(C(=O)c1ccsc1)CC2 | [C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][C][C][Ring1][=Branch1][C][C][N][Branch1][N][C][=Branch1][C][=O][C][C][=C][S][C][=Ring1][Branch1][C][C][Ring1][=N] | N14CCCCC12CCN3CC2.c15ccsc1.CS4(=O)=O.C35=O |
1929663 | O=C(CO)N1CCC2(CC1)COCCN(c1cccnc1)C2 | [O][=C][Branch1][Ring1][C][O][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][O][C][C][N][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][C][Ring1][#C] | N13CCC2(CC1)COCCN4C2.c14cccnc1.O=C3CO |
1929664 | O=C(N1CCCC1)N1CCC2(CC1)COCCN(c1ncccn1)C2 | [O][=C][Branch1][Branch2][N][C][C][C][C][Ring1][Branch1][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][O][C][C][N][Branch1][=Branch2][C][=N][C][=C][C][=N][Ring1][=Branch1][C][Ring1][#C] | N14CCC2(CC1)COCCN5C2.c15ncccn1.N13CCCC1.O=C34 |
1929665 | O=C(c1cc[nH]n1)N1CCC2(CC1)COCCN(c1nccs1)C2 | [O][=C][Branch1][Branch2][C][C][=C][NH1][N][=Ring1][Branch1][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][O][C][C][N][Branch1][Branch2][C][=N][C][=C][S][Ring1][Branch1][C][Ring1][=C] | N13CCC2(CC1)COCCN4C2.c15cc[nH]n1.c14nccs1.O=C35 |
1929666 | CS(=O)(=O)N1CCOCC2(CN(c3ccsc3)C(=O)CO2)C1 | [C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][O][C][C][Branch2][Ring1][Ring2][C][N][Branch1][Branch2][C][C][=C][S][C][=Ring1][Branch1][C][=Branch1][C][=O][C][O][Ring1][N][C][Ring2][Ring1][C] | N14CCOCC2(C1)CN5C(=O)CO2.c15ccsc1.CS4(=O)=O |
1929667 | C1=CC2(CCC1N1CCOCC1)CCN(c1ncccn1)CC2 | [C][=C][C][Branch1][=C][C][C][C][Ring1][=Branch1][N][C][C][O][C][C][Ring1][=Branch1][C][C][N][Branch1][=Branch2][C][=N][C][=C][C][=N][Ring1][=Branch1][C][C][Ring2][Ring1][Branch1] | C1=CC2(CCC14)CCN3CC2.N14CCOCC1.c13ncccn1 |
1929668 | CCOCC1CC2(COCCN2S(=O)(=O)c2ccccc2)CO1 | [C][C][O][C][C][C][C][Branch2][Ring1][#Branch1][C][O][C][C][N][Ring1][=Branch1][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][O][Ring2][Ring1][Ring1] | C16CC2(COCCN25)CO1.S5(=O)(=O)c1ccccc1.CC3.O34.C46 |
1929669 | Cc1ccc(C(=O)N2CC(C(=O)NC(C)C)C3(CCOCC3)C2)cc1 | [C][C][=C][C][=C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C][Branch1][O][C][=Branch1][C][=O][N][C][Branch1][C][C][C][C][Branch1][Branch2][C][C][O][C][C][Ring1][=Branch1][C][Ring1][S][C][=C][Ring2][Ring1][Branch2] | N14CC7C2(CCOCC2)C1.Cc1ccc8cc1.C48=O.C57=O.C6(C)C.N56 |
1929672 | CC(C)NC(=O)C1CN(C(=O)c2ccccc2)CC12CCOCC2 | [C][C][Branch1][C][C][N][C][=Branch1][C][=O][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][=N][C][C][O][C][C][Ring1][=Branch1] | C16CN4CC12CCOCC2.c17ccccc1.CC5C.C36=O.C47=O.N35 |
1929674 | Cc1ccccc1C(=O)N1CC(C(=O)NC(C)C)C2(CCOCC2)C1 | [C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][Branch1][O][C][=Branch1][C][=O][N][C][Branch1][C][C][C][C][Branch1][Branch2][C][C][O][C][C][Ring1][=Branch1][C][Ring1][S] | N13CC6C2(CCOCC2)C1.Cc1ccccc17.C37=O.C46=O.C5(C)C.N45 |
1929675 | Cc1cccc(C(=O)N2CC(C(=O)NC(C)C)C3(CCOCC3)C2)c1 | [C][C][=C][C][=C][C][Branch2][Ring1][P][C][=Branch1][C][=O][N][C][C][Branch1][O][C][=Branch1][C][=O][N][C][Branch1][C][C][C][C][Branch1][Branch2][C][C][O][C][C][Ring1][=Branch1][C][Ring1][S][=C][Ring2][Ring1][Branch2] | N14CC7C2(CCOCC2)C1.Cc1cccc8c1.C48=O.C57=O.C6(C)C.N56 |
1929676 | Cc1ccoc1C(=O)N1CC(C(=O)NCC2CC2)C2(CCOCC2)C1 | [C][C][C][=C][O][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C][Branch1][N][C][=Branch1][C][=O][N][C][C][C][C][Ring1][Ring1][C][Branch1][Branch2][C][C][O][C][C][Ring1][=Branch1][C][Ring1][P] | N13CC7C2(CCOCC2)C1.Cc1ccoc16.C36=O.C47=O.C18CC1.N45.C58 |
1929677 | Cc1ccc(C(=O)N2CC(C(=O)NCC3CC3)C3(CCOCC3)C2)o1 | [C][C][=C][C][=C][Branch2][Ring2][C][C][=Branch1][C][=O][N][C][C][Branch1][N][C][=Branch1][C][=O][N][C][C][C][C][Ring1][Ring1][C][Branch1][Branch2][C][C][O][C][C][Ring1][=Branch1][C][Ring1][P][O][Ring2][Ring1][Branch2] | N14CC8C2(CCOCC2)C1.Cc1ccc7o1.C47=O.C58=O.C19CC1.N56.C69 |
1929678 | O=C1COC2(CN1)COCCN(c1ncccn1)C2 | [O][=C][C][O][C][Branch1][Branch1][C][N][Ring1][=Branch1][C][O][C][C][N][Branch1][=Branch2][C][=N][C][=C][C][=N][Ring1][=Branch1][C][Ring1][#C] | O=C1COC2(CN1)COCCN3C2.c13ncccn1 |
1929679 | CN1CC2(COCCN(c3ncccn3)C2)OCC1=O | [C][N][C][C][Branch2][Ring1][Ring1][C][O][C][C][N][Branch1][=Branch2][C][=N][C][=C][C][=N][Ring1][=Branch1][C][Ring1][=N][O][C][C][Ring2][Ring1][C][=O] | CN1CC2(COCCN4C2)OCC1=O.c14ncccn1 |
1929680 | CN1CC2(COCCN(C(=O)c3ccco3)C2)OCC1=O | [C][N][C][C][Branch2][Ring1][=Branch1][C][O][C][C][N][Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][O][Ring1][Branch1][C][Ring1][=C][O][C][C][Ring2][Ring1][Ring1][=O] | CN1CC2(COCCN4C2)OCC1=O.c15ccco1.C45=O |
1929681 | CCN1CC2(COCCN(c3ncccn3)C2)OCC1=O | [C][C][N][C][C][Branch2][Ring1][Ring1][C][O][C][C][N][Branch1][=Branch2][C][=N][C][=C][C][=N][Ring1][=Branch1][C][Ring1][=N][O][C][C][Ring2][Ring1][C][=O] | N15CC2(COCCN4C2)OCC1=O.c14ncccn1.CC5 |
1929682 | CCN1CC2(COCCN(C(=O)c3ccco3)C2)OCC1=O | [C][C][N][C][C][Branch2][Ring1][=Branch1][C][O][C][C][N][Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][O][Ring1][Branch1][C][Ring1][=C][O][C][C][Ring2][Ring1][Ring1][=O] | N16CC2(COCCN4C2)OCC1=O.c15ccco1.C45=O.CC6 |
1929684 | CC(=O)N1CCC2(CCc3ccc(-c4ccncc4)cc32)CC1 | [C][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][#Branch1][C][C][C][=C][C][=C][Branch1][=Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][C][=C][Ring1][N][Ring1][#C][C][C][Ring2][Ring1][Ring2] | N15CCC2(CCc3ccc6cc32)CC1.c16ccncc1.CC5=O |
1929685 | CS(=O)(=O)N1CCC2(CCc3ccc(-c4ccncc4)cc32)CC1 | [C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][#Branch1][C][C][C][=C][C][=C][Branch1][=Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][C][=C][Ring1][N][Ring1][#C][C][C][Ring2][Ring1][Ring2] | N15CCC2(CCc3ccc6cc32)CC1.c16ccncc1.CS5(=O)=O |
1929686 | CN(C)C(=O)N1CCC2(CCc3ccc(-c4ccncc4)cc32)CC1 | [C][N][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][#Branch1][C][C][C][=C][C][=C][Branch1][=Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][C][=C][Ring1][N][Ring1][#C][C][C][Ring2][Ring1][Ring2] | N16CCC2(CCc3ccc7cc32)CC1.c17ccncc1.CN5C.C56=O |
1929687 | CC(=O)NCC(=O)N1CCC2(CCC(C)c3ccccc32)CC1 | [C][C][=Branch1][C][=O][N][C][C][=Branch1][C][=O][N][C][C][C][Branch1][P][C][C][C][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][O][C][C][Ring1][S] | N15CCC2(CCC(C)c3ccccc32)CC1.C6C5=O.CC4=O.N46 |
1929688 | CC1CCC2(CCN(C(=O)CC#N)CC2)c2ccccc21 | [C][C][C][C][C][Branch1][P][C][C][N][Branch1][Branch2][C][=Branch1][C][=O][C][C][#N][C][C][Ring1][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring2][Ring1][Ring2] | CC1CCC2(CCN3CC2)c2ccccc21.C3(=O)CC#N |
1929689 | CC(=O)N1CCC2(CC1)CC(NC(=O)CC(C)C)c1ccccc1O2 | [C][C][=Branch1][C][=O][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][C][Branch1][N][N][C][=Branch1][C][=O][C][C][Branch1][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][Ring2][Ring1][Ring1] | N13CCC2(CC1)CC(N4)c1ccccc1O2.C4(=O)CC(C)C.CC3=O |
1929690 | CCC(=O)N1CCC2(CC1)CC(CC(=O)N(C)C)c1ccccc1O2 | [C][C][C][=Branch1][C][=O][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][C][Branch1][O][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][Ring2][Ring1][C] | N13CCC2(CC1)CC(CC4=O)c1ccccc1O2.CCC3=O.N4(C)C |
1929691 | CCC(=O)N1CCC2(CC1)CC(CC(=O)NC)c1ccccc1O2 | [C][C][C][=Branch1][C][=O][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][C][Branch1][Branch2][C][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][Ring1][P] | N13CCC2(CC1)CC(CC4=O)c1ccccc1O2.CCC3=O.N4C |
1929692 | CC(=O)N1CCC2(CC1)CC(CC(=O)NC(C)C)c1ccccc1O2 | [C][C][=Branch1][C][=O][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][C][Branch1][N][C][C][=Branch1][C][=O][N][C][Branch1][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][Ring2][Ring1][Ring1] | N13CCC2(CC1)CC(CC4=O)c1ccccc1O2.CC3=O.C5(C)C.N45 |
1929693 | CN1C(=O)C2(CC2C(=O)Nc2cccnc2)c2ccccc21 | [C][N][C][=Branch1][C][=O][C][Branch2][Ring1][C][C][C][Ring1][Ring1][C][=Branch1][C][=O][N][C][=C][C][=C][N][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring2][Ring1][Branch1] | CN1C(=O)C2(CC25)c2ccccc21.c14cccnc1.C35=O.N34 |
1929694 | Cc1ccc(NC(=O)C2CC23C(=O)N(C)c2ccccc23)cn1 | [C][C][=C][C][=C][Branch2][Ring1][=N][N][C][=Branch1][C][=O][C][C][C][Ring1][Ring1][C][=Branch1][C][=O][N][Branch1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][O][C][=N][Ring2][Ring1][=Branch1] | C16CC12C(=O)N(C)c1ccccc12.Cc1ccc5cn1.C46=O.N45 |
1929695 | O=C(NCc1ccco1)C1CC12C(=O)N(CC1CC1)c1ccccc12 | [O][=C][Branch1][#Branch2][N][C][C][=C][C][=C][O][Ring1][Branch1][C][C][C][Ring1][Ring1][C][=Branch1][C][=O][N][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][=C] | C15CC12C(=O)N(C7)c1ccccc12.c16ccco1.O=C35.C17CC1.N34.C46 |
1929696 | CC(C)NC(=O)N1CCC2(CC1)OCCN(CCO)c1ccccc12 | [C][C][Branch1][C][C][N][C][=Branch1][C][=O][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][O][C][C][N][Branch1][Ring2][C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][S] | N14CCC2(CC1)OCCN6c1ccccc12.CC5C.C34=O.C6CO.N35 |
1929698 | c1cnc(N2CCC3(COCc4cnc(-c5cccnc5)nc43)C2)nc1 | [C][=C][N][=C][Branch2][Ring2][Ring1][N][C][C][C][Branch2][Ring1][Branch2][C][O][C][C][=C][N][=C][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][N][=C][Ring1][N][Ring1][S][C][Ring2][Ring1][Ring2][N][=C][Ring2][Ring1][#Branch2] | N16CCC2(COCc3cnc7nc32)C1.c1cnc6nc1.c17cccnc1 |
1929699 | c1ccc(-c2ncc3c(n2)C2(CCN(c4ncccn4)C2)COC3)cc1 | [C][=C][C][=C][Branch2][Ring2][Ring1][C][=N][C][=C][C][=Branch1][Ring2][=N][Ring1][=Branch1][C][Branch1][P][C][C][N][Branch1][=Branch2][C][=N][C][=C][C][=N][Ring1][=Branch1][C][Ring1][O][C][O][C][Ring1][P][C][=C][Ring2][Ring1][#Branch2] | c16ncc2c(n1)C1(CCN5C1)COC2.c1ccc6cc1.c15ncccn1 |
1929700 | Cc1nc(N(C)C)nc2c1COCC21CCN(C(=O)C2CC2)C1 | [C][C][=N][C][Branch1][=Branch1][N][Branch1][C][C][C][=N][C][=C][Ring1][=Branch2][C][O][C][C][Ring1][=Branch1][C][C][N][Branch1][#Branch2][C][=Branch1][C][=O][C][C][C][Ring1][Ring1][C][Ring1][#Branch2] | Cc1nc4nc2c1COCC21CCN3C1.N4(C)C.C35=O.C15CC1 |
1929701 | N#Cc1ccc(N2CC3CN(CC4CC4)C(=O)C3C2)nc1 | [N][#C][C][=C][C][=C][Branch2][Ring1][Branch2][N][C][C][C][N][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][C][=Branch1][C][=O][C][Ring1][#Branch2][C][Ring1][=N][N][=C][Ring2][Ring1][Ring1] | N15CC2CN6C(=O)C2C1.N#Cc1ccc5nc1.C17CC1.C67 |
1929703 | O=C(C1CC=CC1)N1CC2CN(Cc3ccncc3)C(=O)C2C1 | [O][=C][Branch1][Branch2][C][C][C][=C][C][Ring1][Branch1][N][C][C][C][N][Branch1][#Branch2][C][C][=C][C][=N][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][Ring1][=N][C][Ring1][S] | N14CC2CN6C(=O)C2C1.c17ccncc1.C15CC=CC1.O=C45.C67 |
1929704 | Cc1cnc(C(=O)N2CC3CN(c4ccccc4)C(=O)C3C2)cn1 | [C][C][=C][N][=C][Branch2][Ring1][=C][C][=Branch1][C][=O][N][C][C][C][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][Ring1][N][C][Ring1][#C][C][=N][Ring2][Ring1][#Branch1] | N15CC2CN7C(=O)C2C1.Cc1cnc6cn1.c17ccccc1.C56=O |
1929705 | O=C(CC1CC1)N1CC2CN(c3ccccc3)C(=O)C2C1 | [O][=C][Branch1][#Branch1][C][C][C][C][Ring1][Ring1][N][C][C][C][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][Ring1][N][C][Ring1][#C] | N14CC2CN6C(=O)C2C1.c16ccccc1.O=C4C5.C15CC1 |
1929706 | Cn1cccc1C(=O)N1CC2CN(c3cccnc3)C(=O)C2C1 | [C][N][C][=C][C][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][N][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][Ring1][N][C][Ring1][#C] | N14CC2CN6C(=O)C2C1.Cn1cccc15.c16cccnc1.C45=O |
1929707 | O=C1C2CN(c3cccnc3)CC2CN1c1cncnc1 | [O][=C][C][C][N][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][C][C][Ring1][O][C][N][Ring1][=C][C][=C][N][=C][N][=C][Ring1][=Branch1] | O=C1C2CN4CC2CN15.c14cccnc1.c15cncnc1 |
1929708 | O=C(c1ccsc1)N1CC2CN(c3cncnc3)C(=O)C2C1 | [O][=C][Branch1][Branch2][C][C][=C][S][C][=Ring1][Branch1][N][C][C][C][N][Branch1][=Branch2][C][=C][N][=C][N][=C][Ring1][=Branch1][C][=Branch1][C][=O][C][Ring1][N][C][Ring1][#C] | N14CC2CN6C(=O)C2C1.c16cncnc1.c15ccsc1.O=C45 |
1929709 | COCC(=O)N1CC2CN(c3cnn(C)c3)C(=O)C2C1 | [C][O][C][C][=Branch1][C][=O][N][C][C][C][N][Branch1][O][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][C][=Branch1][C][=O][C][Ring1][N][C][Ring1][#C] | N14CC2CN6C(=O)C2C1.c16cnn(C)c1.C5C4=O.CO5 |
1929710 | Cn1cc(N2CC3CN(C(=O)c4cccn4C)CC3C2=O)cn1 | [C][N][C][=C][Branch2][Ring1][N][N][C][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][C][=C][N][Ring1][Branch1][C][C][C][Ring1][=N][C][Ring1][S][=O][C][=N][Ring2][Ring1][=Branch1] | N17CC2CN5CC2C1=O.Cn1cc7cn1.c16cccn1C.C56=O |
1929711 | COCCC(=O)N1CC2CN(c3cnn(C)c3)C(=O)C2C1 | [C][O][C][C][C][=Branch1][C][=O][N][C][C][C][N][Branch1][O][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][C][=Branch1][C][=O][C][Ring1][N][C][Ring1][#C] | N14CC2CN6C(=O)C2C1.c16cnn(C)c1.C5CC4=O.CO5 |
1929712 | Cn1cc(N2CC3CN(C(=O)c4ccc[nH]4)CC3C2=O)cn1 | [C][N][C][=C][Branch2][Ring1][O][N][C][C][C][N][Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][NH1][Ring1][Branch1][C][C][Ring1][N][C][Ring1][#C][=O][C][=N][Ring2][Ring1][Branch1] | N17CC2CN5CC2C1=O.Cn1cc7cn1.c16ccc[nH]1.C56=O |
1929713 | Cc1cccc(CN2CC3CN(S(=O)(=O)C4CC4)CC3C2=O)c1 | [C][C][=C][C][=C][C][Branch2][Ring1][=N][C][N][C][C][C][N][Branch1][=N][S][=Branch1][C][=O][=Branch1][C][=O][C][C][C][Ring1][Ring1][C][C][Ring1][O][C][Ring1][=C][=O][=C][Ring2][Ring1][=Branch1] | N16CC2CN5CC2C1=O.Cc1cccc7c1.S5(=O)(=O)C1CC1.C67 |
1929714 | Cc1cccc(CN2CC3CN(C(=O)c4conc4C)CC3C2=O)c1 | [C][C][=C][C][=C][C][Branch2][Ring1][=N][C][N][C][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][O][N][=C][Ring1][Branch1][C][C][C][Ring1][=N][C][Ring1][S][=O][=C][Ring2][Ring1][Branch2] | N17CC2CN5CC2C1=O.Cc1cccc8c1.c16conc1C.C56=O.C78 |
1929715 | Cc1cccc(CN2CC3CN(c4ncccn4)CC3C2=O)n1 | [C][C][=C][C][=C][C][Branch2][Ring1][=Branch2][C][N][C][C][C][N][Branch1][=Branch2][C][=N][C][=C][C][=N][Ring1][=Branch1][C][C][Ring1][O][C][Ring1][=C][=O][=N][Ring2][Ring1][=Branch1] | N16CC2CN5CC2C1=O.Cc1cccc7n1.c15ncccn1.C67 |
1929716 | Cc1cnc(N2CC3CN(Cc4cccc(C)n4)C(=O)C3C2)nc1 | [C][C][=C][N][=C][Branch2][Ring1][=C][N][C][C][C][N][Branch1][=N][C][C][=C][C][=C][C][Branch1][C][C][=N][Ring1][#Branch1][C][=Branch1][C][=O][C][Ring1][=C][C][Ring1][P][N][=C][Ring2][Ring1][#Branch1] | N15CC2CN6C(=O)C2C1.Cc1cnc5nc1.c17cccc(C)n1.C67 |
1929717 | Cn1cc(N2CC3CN(C(=O)CCO)CC3C2=O)cn1 | [C][N][C][=C][Branch2][Ring1][#Branch1][N][C][C][C][N][Branch1][Branch2][C][=Branch1][C][=O][C][C][O][C][C][Ring1][#Branch2][C][Ring1][=N][=O][C][=N][Ring2][Ring1][Ring1] | N15CC2CN4CC2C1=O.Cn1cc5cn1.C4(=O)CCO |
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