ID large_stringlengths 1 7 | smiles stringlengths 15 57 | selfies stringlengths 55 294 | safe stringlengths 15 83 |
|---|---|---|---|
1921978 | CN(C)C(C(=O)NCCCN1CCOCC1)c1ccc(F)cc1 | [C][N][Branch1][C][C][C][Branch1][P][C][=Branch1][C][=O][N][C][C][C][N][C][C][O][C][C][Ring1][=Branch1][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1] | c16ccc(F)cc1.N15CCOCC1.C36C2=O.C4CC5.CN3C.N24 |
1921979 | c1ccc(COC2CCCC2Nc2nnc(C3CC3)o2)cc1 | [C][=C][C][=C][Branch2][Ring1][=Branch2][C][O][C][C][C][C][C][Ring1][Branch1][N][C][=N][N][=C][Branch1][=Branch1][C][C][C][Ring1][Ring1][O][Ring1][Branch2][C][=C][Ring2][Ring1][=Branch1] | c1ccc8cc1.C15CCCC17.c16nnc9o1.C19CC1.C48.O45.N67 |
1921980 | CCc1cnc(N2CCCN(S(=O)(=O)N3CCCC3)CC2)nc1 | [C][C][C][=C][N][=C][Branch2][Ring1][#Branch2][N][C][C][C][N][Branch1][#C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][C][Ring1][Branch1][C][C][Ring1][#C][N][=C][Ring2][Ring1][Branch1] | N14CCCN(S(=O)(=O)N2CCCC2)CC1.c15cnc4nc1.CC5 |
1921981 | Cc1nnc(N2CCC(COc3ccc4c(c3)CCC4)CC2)o1 | [C][C][=N][N][=C][Branch2][Ring1][=N][N][C][C][C][Branch2][Ring1][C][C][O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][C][Ring1][=Branch1][C][C][Ring1][P][O][Ring2][Ring1][=Branch1] | c16ccc2c(c1)CCC2.N17CCC8CC1.Cc1nnc7o1.C58.O56 |
1921982 | CCN(Cc1cnn(C)c1)C(=O)C(c1cccc(C)c1)N(C)C | [C][C][N][Branch1][N][C][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][C][=Branch1][C][=O][C][Branch1][N][C][=C][C][=C][C][Branch1][C][C][=C][Ring1][#Branch1][N][Branch1][C][C][C] | c17cccc(C)c1.c16cnn(C)c1.C2(=O)C57.N234.N5(C)C.CC3.C46 |
1921983 | C=CCc1c(C)nc(N)nc1N1CCc2ncccc2C1 | [C][=C][C][C][=C][Branch1][C][C][N][=C][Branch1][C][N][N][=C][Ring1][Branch2][N][C][C][C][=N][C][=C][C][=C][Ring1][=Branch1][C][Ring1][#Branch2] | N13CCc2ncccc2C1.c14c3nc(N)nc1C.C=CC4 |
1921984 | CCCc1nnsc1C(=O)N1CCCC(OCc2cccnc2)C1 | [C][C][C][C][N][=N][S][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][C][Branch1][O][O][C][C][=C][C][=C][N][=C][Ring1][=Branch1][C][Ring1][=C] | N13CCCC5C1.c17nnsc16.c18cccnc1.CCC7.C36=O.O45.C48 |
1921985 | CCc1noc(-c2c[nH]nc2-c2cccc(OC)c2)n1 | [C][C][C][=N][O][C][Branch2][Ring1][Ring2][C][=C][NH1][N][=C][Ring1][Branch1][C][=C][C][=C][C][Branch1][Ring1][O][C][=C][Ring1][Branch2][=N][Ring2][Ring1][C] | c16cccc3c1.c14noc5n1.c15c[nH]nc16.CC4.O3C |
1921986 | O=c1c2cccn2cnn1CCc1c[nH]c2ccccc12 | [O][=C][C][=C][C][=C][N][Ring1][Branch1][C][=N][N][Ring1][=Branch2][C][C][C][=C][NH1][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1] | O=c1c2cccn2cnn13.c14c[nH]c2ccccc12.C3C4 |
1921987 | COCC(=O)N1CCCC(C(=O)NCCSc2ccccn2)C1 | [C][O][C][C][=Branch1][C][=O][N][C][C][C][C][Branch1][P][C][=Branch1][C][=O][N][C][C][S][C][=C][C][=C][C][=N][Ring1][=Branch1][C][Ring2][Ring1][C] | N13CCCC8C1.c19ccccn1.C5C3=O.C48=O.C6C7.CO5.N46.S79 |
1921988 | Cc1ccc(CN(CCO)C(=O)C2CCCN(C(=O)N(C)C)C2)cc1 | [C][C][=C][C][=C][Branch2][Ring1][#C][C][N][Branch1][Ring2][C][C][O][C][=Branch1][C][=O][C][C][C][C][N][Branch1][#Branch2][C][=Branch1][C][=O][N][Branch1][C][C][C][C][Ring1][O][C][=C][Ring2][Ring1][Branch2] | Cc1ccc9cc1.C18CCCN4C1.N367.C7CO.C38=O.C45=O.N5(C)C.C69 |
1921989 | Cc1ncsc1CN1C(=O)CSc2ccccc21 | [C][C][N][=C][S][C][=Ring1][Branch1][C][N][C][=Branch1][C][=O][C][S][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][O] | C3N1C(=O)CSc2ccccc21.Cc1ncsc13 |
1921990 | Cc1cc(CC2COCC2NC(=O)c2n[nH]c3c2CCCC3)on1 | [C][C][C][=C][Branch2][Ring1][O][C][C][C][O][C][C][Ring1][Branch1][N][C][=Branch1][C][=O][C][=N][NH1][C][=C][Ring1][Branch1][C][C][C][C][Ring1][=Branch1][O][N][=Ring2][Ring1][#Branch1] | c16n[nH]c2c1CCCC2.Cc1cc7on1.C18COCC15.C46=O.C78.N45 |
1921991 | O=C(c1ccc2nccn2c1)N1CCC2(CC1)OCCCC2O | [O][=C][Branch1][=C][C][C][=C][C][=N][C][=C][N][Ring1][Branch1][C][=Ring1][=Branch2][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][O][C][C][C][C][Ring1][Branch2][O] | N13CCC2(CC1)OCCCC2O.c14ccc2nccn2c1.O=C34 |
1921992 | Fc1ccc2c(NCc3csc(N4CCOCC4)n3)ncnc2c1 | [F][C][=C][C][=C][C][Branch2][Ring1][Ring2][N][C][C][=C][S][C][Branch1][=Branch2][N][C][C][O][C][C][Ring1][=Branch1][=N][Ring1][O][=N][C][=N][C][Ring2][Ring1][Ring1][=C][Ring2][Ring1][#Branch1] | Fc1ccc2c6ncnc2c1.c18csc7n1.N17CCOCC1.N56.C58 |
1921993 | Cc1nncn1CCn1sc2ccccc2c1=O | [C][C][=N][N][=C][N][Ring1][Branch1][C][C][N][S][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][=Branch2][=O] | n14sc2ccccc2c1=O.Cc1nncn13.C3C4 |
1921994 | Cn1c(=O)oc2ccc(S(=O)(=O)N3CCc4[nH]cnc4C3)cc21 | [C][N][C][=Branch1][C][=O][O][C][=C][C][=C][Branch2][Ring1][Branch1][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][NH1][C][=N][C][=Ring1][Branch1][C][Ring1][=Branch2][C][=C][Ring2][Ring1][C][Ring2][Ring1][=Branch1] | Cn1c(=O)oc2ccc(S5(=O)=O)cc21.N15CCc2[nH]cnc2C1 |
1921995 | Cc1ccccc1C(C(=O)N(Cc1cnn(C)c1)CC(C)C)N(C)C | [C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch2][Ring1][=Branch2][C][=Branch1][C][=O][N][Branch1][N][C][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][C][C][Branch1][C][C][C][N][Branch1][C][C][C] | Cc1ccccc16.c17cnn(C)c1.C36C2=O.C5C(C)C.N245.N3(C)C.C47 |
1921996 | CCc1c(C)nc(N)nc1N1CCC2(O)CCN(C(C)=O)CC2C1 | [C][C][C][=C][Branch1][C][C][N][=C][Branch1][C][N][N][=C][Ring1][Branch2][N][C][C][C][Branch1][C][O][C][C][N][Branch1][=Branch1][C][Branch1][C][C][=O][C][C][Ring1][#Branch2][C][Ring1][=C] | N14CCC2(O)CCN3CC2C1.c15c4nc(N)nc1C.C3(C)=O.CC5 |
1921997 | Cc1ocnc1C(=O)N1CCC2(CC1)CC(=O)N(CC1CCCO1)C2 | [C][C][O][C][=N][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][C][=Branch1][C][=O][N][Branch1][=Branch2][C][C][C][C][C][O][Ring1][Branch1][C][Ring1][=C] | N13CCC2(CC1)CC(=O)N5C2.Cc1ocnc14.C16CCCO1.C34=O.C56 |
1921998 | Cc1cccc2cc(C(=O)NCc3ccc(-n4cccn4)cc3)n(C)c12 | [C][C][=C][C][=C][C][C][=C][Branch2][Ring1][Branch2][C][=Branch1][C][=O][N][C][C][=C][C][=C][Branch1][Branch2][N][C][=C][C][=N][Ring1][Branch1][C][=C][Ring1][O][N][Branch1][C][C][C][Ring2][Ring1][=Branch2][=Ring2][Ring1][Branch1] | Cc1cccc2cc7n(C)c12.c18ccc9cc1.n19cccn1.C57=O.N56.C68 |
1921999 | Cc1cccc(CC(C)NCc2cc(=O)c3cc(F)ccc3[nH]2)n1 | [C][C][=C][C][=C][C][Branch2][Ring1][N][C][C][Branch1][C][C][N][C][C][=C][C][=Branch1][C][=O][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][#Branch1][NH1][Ring1][N][=N][Ring2][Ring1][#Branch1] | c17cc(=O)c2cc(F)ccc2[nH]1.Cc1cccc6n1.C6C4C.N45.C57 |
1922000 | CCNC(=O)C1CCN(c2ncnc3nc(C)cc(C)c23)C1 | [C][C][N][C][=Branch1][C][=O][C][C][C][N][Branch2][Ring1][Branch1][C][=N][C][=N][C][=N][C][Branch1][C][C][=C][C][Branch1][C][C][=C][Ring1][N][Ring1][Branch2][C][Ring1][P] | c16ncnc2nc(C)cc(C)c12.C17CCN6C1.C47=O.CC5.N45 |
1922001 | Cc1nc(NCc2ccc3c(c2)OCO3)c2cccnc2n1 | [C][C][=N][C][Branch2][Ring1][C][N][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][O][Ring1][=Branch1][=C][C][=C][C][=N][C][Ring1][=Branch1][=N][Ring2][Ring1][Branch1] | Cc1nc5c2cccnc2n1.c16ccc2c(c1)OCO2.N45.C46 |
1922002 | CC(=O)N1CCCC(C(=O)N2CCC(Cc3noc(C)n3)CC2)C1 | [C][C][=Branch1][C][=O][N][C][C][C][C][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][N][C][C][C][Branch1][N][C][C][=N][O][C][Branch1][C][C][=N][Ring1][=Branch1][C][C][Ring1][=N][C][Ring2][Ring1][Branch1] | N14CCCC6C1.N15CCC8CC1.c17noc(C)n1.CC4=O.C56=O.C78 |
1922003 | CC1(c2ccccc2)CCCN(c2nc(CO)cs2)C1 | [C][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][C][N][Branch1][N][C][=N][C][Branch1][Ring1][C][O][=C][S][Ring1][#Branch1][C][Ring2][Ring1][Ring1] | CC15CCCN3C1.c15ccccc1.c13nc4cs1.C4O |
1922004 | CC(C)c1ccnc(NCC(O)c2ccccc2Cl)n1 | [C][C][Branch1][C][C][C][=C][C][=N][C][Branch1][S][N][C][C][Branch1][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl][=N][Ring1][P] | c15ccnc4n1.c16ccccc1Cl.C3C6O.CC5C.N34 |
1922005 | Cc1nc2ccccc2n(CCC2CCOC2)c1=O | [C][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Branch1][#Branch2][C][C][C][C][C][O][C][Ring1][Branch1][C][Ring1][P][=O] | Cc1nc2ccccc2n3c1=O.C14CCOC1.C3C4 |
1922006 | O=C(NCCn1cccc1)C(c1cccnc1)N1CCCC1 | [O][=C][Branch1][O][N][C][C][N][C][=C][C][=C][Ring1][Branch1][C][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][N][C][C][C][C][Ring1][Branch1] | c16cccnc1.O=C2C46.n15cccc1.N14CCCC1.C3C5.N23 |
1922007 | CN(Cc1cc[nH]n1)C(=O)C1CC(=O)N(Cc2ccncc2)C1 | [C][N][Branch1][=Branch2][C][C][C][=C][NH1][N][=Ring1][Branch1][C][=Branch1][C][=O][C][C][C][=Branch1][C][=O][N][Branch1][#Branch2][C][C][=C][C][=N][C][=C][Ring1][=Branch1][C][Ring1][=N] | C15CC(=O)N6C1.c18ccncc1.c17cc[nH]n1.CN34.C35=O.C47.C68 |
1922008 | O=c1ccc2ccccc2n1Cc1noc(C2CCCO2)n1 | [O][=C][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Ring1][#Branch2][C][C][=N][O][C][Branch1][Branch2][C][C][C][C][O][Ring1][Branch1][=N][Ring1][#Branch2] | O=c1ccc2ccccc2n13.c14noc5n1.C15CCCO1.C34 |
1922009 | COc1cccc2c1OCC(Cc1cncc(N(C)C)n1)C2 | [C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][C][Branch1][P][C][C][=C][N][=C][C][Branch1][=Branch1][N][Branch1][C][C][C][=N][Ring1][=Branch2][C][Ring1][S] | c13cccc2c1OCC6C2.c15cncc4n1.N4(C)C.CO3.C56 |
1922010 | CCc1ncc(C(=O)NCCc2cc(=O)[nH]c(C)n2)cn1 | [C][C][C][=N][C][=C][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C][=C][C][=Branch1][C][=O][NH1][C][Branch1][C][C][=N][Ring1][Branch2][C][=N][Ring2][Ring1][Ring1] | c17cc(=O)[nH]c(C)n1.c16ncc5cn1.C35=O.C4C7.CC6.N34 |
1922011 | COCC1CCCN1C(=O)c1cnc(-c2cccnc2)nc1 | [C][O][C][C][C][C][C][N][Ring1][Branch1][C][=Branch1][C][=O][C][=C][N][=C][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][N][=C][Ring1][N] | c15cnc7nc1.C16CCCN13.c17cccnc1.C35=O.CO4.C46 |
1922012 | COCc1noc(CCNC(=O)C2COc3c(cccc3OC)C2)n1 | [C][O][C][C][=N][O][C][Branch2][Ring1][#Branch2][C][C][N][C][=Branch1][C][=O][C][C][O][C][=C][Branch1][=Branch2][C][=C][C][=C][Ring1][=Branch1][O][C][C][Ring1][N][=N][Ring2][Ring1][=Branch1] | C18COc2c6cccc2C1.c19noc%10n1.C%10C7.C48=O.CO5.C59.N47.O6C |
1922013 | Cc1cc(=O)[nH]c(CCNC(=O)C(c2ccccc2C)N(C)C)n1 | [C][C][=C][C][=Branch1][C][=O][NH1][C][Branch2][Ring1][=Branch2][C][C][N][C][=Branch1][C][=O][C][Branch1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][N][Branch1][C][C][C][=N][Ring2][Ring1][#Branch1] | Cc1cc(=O)[nH]c6n1.c17ccccc1C.C3(=O)C57.C6C4.N5(C)C.N34 |
1922014 | OC1CCCOC12CCN(c1ccc(-c3ccc(F)cc3)nn1)CC2 | [O][C][C][C][C][O][C][Ring1][=Branch1][C][C][N][Branch2][Ring1][=Branch1][C][=C][C][=C][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][N][=N][Ring1][=N][C][C][Ring2][Ring1][Ring1] | OC1CCCOC12CCN4CC2.c14ccc5nn1.c15ccc(F)cc1 |
1922015 | CC(C)(C)c1nnc(N2CC3C4CCC(O4)C3C2)o1 | [C][C][Branch1][C][C][Branch1][C][C][C][=N][N][=C][Branch2][Ring1][Ring1][N][C][C][C][C][C][C][Branch1][Ring2][O][Ring1][Branch1][C][Ring1][#Branch1][C][Ring1][#Branch2][O][Ring1][#C] | N15CC2C3CCC(O3)C2C1.c16nnc5o1.CC6(C)C |
1922016 | Cc1nc2cc(CNc3ncnc4cc(F)ccc34)ccc2n1C | [C][C][=N][C][=C][C][Branch2][Ring1][Ring2][C][N][C][=N][C][=N][C][=C][C][Branch1][C][F][=C][C][=C][Ring1][O][Ring1][#Branch1][=C][C][=C][Ring2][Ring1][Ring1][N][Ring2][Ring1][=Branch1][C] | Cc1nc2cc7ccc2n1C.c16ncnc2cc(F)ccc12.C57.N56 |
1922017 | CC(=O)c1cnc(NCCn2nc(C)c(Cl)c2C)nc1C | [C][C][=Branch1][C][=O][C][=C][N][=C][Branch2][Ring1][C][N][C][C][N][N][=C][Branch1][C][C][C][Branch1][C][Cl][=C][Ring1][#Branch1][C][N][=C][Ring1][P][C] | c15cnc4nc1C.n16nc(C)c(Cl)c1C.CC5=O.C3C6.N34 |
1922018 | CCN(CC1CCOCC1)C(=O)C(c1cccnc1)N1CCOCC1 | [C][C][N][Branch1][#Branch2][C][C][C][C][O][C][C][Ring1][=Branch1][C][=Branch1][C][=O][C][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][N][C][C][O][C][C][Ring1][=Branch1] | C16CCOCC1.c17cccnc1.N15CCOCC1.C2(=O)C57.N234.CC3.C46 |
1922019 | CCc1ncc(C(=O)N2CCN(c3ncccc3C(N)=O)CC2)cn1 | [C][C][C][=N][C][=C][Branch2][Ring1][N][C][=Branch1][C][=O][N][C][C][N][Branch1][=C][C][=N][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][N][=O][C][C][Ring1][#C][C][=N][Ring2][Ring1][#Branch1] | c18ncc6cn1.N14CCN5CC1.c15ncccc17.C46=O.C7(N)=O.CC8 |
1922020 | Cc1c(Cl)cc(C(=O)N2CCC3(CCO3)CC2)cc1Cl | [C][C][=C][Branch1][C][Cl][C][=C][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][C][Branch1][=Branch1][C][C][O][Ring1][Ring2][C][C][Ring1][=Branch2][C][=C][Ring2][Ring1][C][Cl] | Cc1c(Cl)cc5cc1Cl.N14CCC2(CCO2)CC1.C45=O |
1922021 | CCc1ncc(C(=O)NCCOc2cccc3cccnc23)cn1 | [C][C][C][=N][C][=C][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][O][C][=C][C][=C][C][=C][C][=C][N][=C][Ring1][#Branch2][Ring1][=Branch1][C][=N][Ring2][Ring1][=Branch1] | c16cccc2cccnc12.c19ncc8cn1.C48=O.C7C5.CC9.N47.O56 |
1922022 | Cc1cc(C)c2c(NCCc3noc(C4CCC4)n3)ncnc2n1 | [C][C][=C][C][Branch1][C][C][=C][C][Branch2][Ring1][Ring1][N][C][C][C][=N][O][C][Branch1][#Branch1][C][C][C][C][Ring1][Ring2][=N][Ring1][=Branch2][=N][C][=N][C][Ring2][Ring1][C][=N][Ring2][Ring1][#Branch1] | Cc1cc(C)c2c6ncnc2n1.c17noc8n1.C18CCC1.C5C7.N56 |
1922024 | Cc1ncc(S(C)(=O)=O)c(NCCc2noc(CO)n2)n1 | [C][C][=N][C][=C][Branch1][=Branch2][S][Branch1][C][C][=Branch1][C][=O][=O][C][Branch1][#C][N][C][C][C][=N][O][C][Branch1][Ring1][C][O][=N][Ring1][#Branch1][=N][Ring2][Ring1][Ring2] | Cc1ncc(S(C)(=O)=O)c4n1.c15noc6n1.C3C5.N34.C6O |
1922025 | CC1(C)CNC(=O)c2nc(-c3cnn(Cc4ccccc4)c3)[nH]c2C1 | [C][C][Branch1][C][C][C][N][C][=Branch1][C][=O][C][N][=C][Branch2][Ring1][Ring1][C][C][=N][N][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Ring1][N][NH1][C][=Ring1][P][C][Ring2][Ring1][Branch2] | CC1(C)CNC(=O)c2nc7[nH]c2C1.c17cnn5c1.c16ccccc1.C56 |
1922026 | COc1cc(CNc2ncc(F)c(N(C)C)n2)cc(OC)c1OC | [C][O][C][=C][C][Branch2][Ring1][Branch1][C][N][C][=N][C][=C][Branch1][C][F][C][Branch1][=Branch1][N][Branch1][C][C][C][=N][Ring1][#Branch2][=C][C][Branch1][Ring1][O][C][=C][Ring2][Ring1][Ring2][O][C] | c13cc9cc4c15.c17ncc(F)c8n1.N8(C)C.CO3.C69.N67.O4C.O5C |
1922027 | COc1ccnc(Cn2ccc3c(OC)c(OC)ccc3c2=O)c1 | [C][O][C][=C][C][=N][C][Branch2][Ring1][=Branch2][C][N][C][=C][C][=C][Branch1][Ring1][O][C][C][Branch1][Ring1][O][C][=C][C][=C][Ring1][#Branch2][C][Ring1][=C][=O][=C][Ring2][Ring1][=Branch1] | n17ccc2c5c6ccc2c1=O.c14ccnc8c1.CO4.C78.O5C.O6C |
1922028 | CCN(Cc1cnn(CC)c1)C(=O)C(c1ccc(F)cc1)N(C)C | [C][C][N][Branch1][=N][C][C][C][=N][N][Branch1][Ring1][C][C][C][=Ring1][#Branch1][C][=Branch1][C][=O][C][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][N][Branch1][C][C][C] | c18ccc(F)cc1.c17cnn6c1.C2(=O)C58.N234.N5(C)C.CC3.C47.C6C |
1922029 | CCc1cnc(N)nc1NCC1(Cn2nc(C)cc2C)CC1 | [C][C][C][=C][N][=C][Branch1][C][N][N][=C][Ring1][#Branch1][N][C][C][Branch1][=N][C][N][N][=C][Branch1][C][C][C][=C][Ring1][=Branch1][C][C][C][Ring1][O] | c18cnc(N)nc14.n15nc(C)cc1C.C167CC1.CC8.N34.C36.C57 |
1922030 | COc1cccc(CNC(=O)C(c2ccc(F)cc2)N(C)C)c1OC | [C][O][C][=C][C][=C][C][Branch2][Ring1][#Branch2][C][N][C][=Branch1][C][=O][C][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][N][Branch1][C][C][C][=C][Ring2][Ring1][Branch1][O][C] | c14cccc8c15.c19ccc(F)cc1.C3(=O)C79.N7(C)C.CO4.C68.N36.O5C |
1922031 | Cc1csc(CCCNc2nccc(C(F)(F)F)n2)n1 | [C][C][=C][S][C][Branch2][Ring1][#Branch1][C][C][C][N][C][=N][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=N][Ring1][#Branch2][=N][Ring2][Ring1][Ring1] | c14nccc6n1.Cc1csc5n1.C5CC3.C6(F)(F)F.N34 |
1922032 | CN(C)C(C(=O)NCCSc1ncn[nH]1)c1cccc(F)c1 | [C][N][Branch1][C][C][C][Branch1][S][C][=Branch1][C][=O][N][C][C][S][C][=N][C][=N][NH1][Ring1][Branch1][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1] | c16cccc(F)c1.C36C2=O.c17ncn[nH]1.CN3C.C4C5.N24.S57 |
1922034 | CCCc1nnc(N2CCC(c3nc4ccccc4n3C)CC2)o1 | [C][C][C][C][=N][N][=C][Branch2][Ring1][=Branch2][N][C][C][C][Branch1][#C][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Ring1][=Branch2][C][C][C][Ring1][S][O][Ring2][Ring1][Branch1] | c17nc2ccccc2n1C.N15CCC7CC1.c16nnc5o1.CCC6 |
1922035 | Cc1nc(N(C)C)ncc1C(=O)NCc1cn2c(C)csc2n1 | [C][C][=N][C][Branch1][=Branch1][N][Branch1][C][C][C][=N][C][=C][Ring1][=Branch2][C][=Branch1][C][=O][N][C][C][=C][N][C][Branch1][C][C][=C][S][C][Ring1][=Branch1][=N][Ring1][=Branch2] | c17cn2c(C)csc2n1.Cc1nc5ncc16.N5(C)C.C36=O.N34.C47 |
1922036 | CN(Cc1cccc(O)c1)C(=O)C(c1cccc(F)c1)N(C)C | [C][N][Branch1][=N][C][C][=C][C][=C][C][Branch1][C][O][=C][Ring1][#Branch1][C][=Branch1][C][=O][C][Branch1][N][C][=C][C][=C][C][Branch1][C][F][=C][Ring1][#Branch1][N][Branch1][C][C][C] | c15cccc(O)c1.c16cccc(F)c1.C2(=O)C46.CN23.N4(C)C.C35 |
1922037 | Cc1noc2ncnc(N(C)Cc3cc(-c4cccnc4)no3)c12 | [C][C][=N][O][C][=N][C][=N][C][Branch2][Ring1][#Branch1][N][Branch1][C][C][C][C][=C][C][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][=N][O][Ring1][O][=C][Ring2][Ring1][#Branch1][Ring2][Ring1][Ring2] | Cc1noc2ncnc6c12.c17cc8no1.c18cccnc1.N56C.C57 |
1922038 | Cc1nnc(SCCCn2cc(-c3nccs3)nn2)s1 | [C][C][=N][N][=C][Branch2][Ring1][Branch1][S][C][C][C][N][C][=C][Branch1][Branch2][C][=N][C][=C][S][Ring1][Branch1][N][=N][Ring1][#Branch2][S][Ring2][Ring1][Ring1] | Cc1nnc6s1.n15cc7nn1.c17nccs1.C4CC5.S46 |
1922039 | CCN1CC(C(=O)NCc2nnnn2-c2ccccc2)CC1=O | [C][C][N][C][C][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][=N][N][=N][N][Ring1][Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring2][Ring1][Ring2][=O] | N16CC5CC1=O.c17nnnn18.c18ccccc1.C35=O.CC6.N34.C47 |
1922041 | Cc1ccc(C(C(=O)NCCc2nc(C)cc(=O)[nH]2)N(C)C)cc1 | [C][C][=C][C][=C][Branch2][Ring1][#C][C][Branch2][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C][=N][C][Branch1][C][C][=C][C][=Branch1][C][=O][NH1][Ring1][Branch2][N][Branch1][C][C][C][C][=C][Ring2][Ring1][#Branch1] | c16nc(C)cc(=O)[nH]1.Cc1ccc7cc1.C47C3=O.C5C6.N4(C)C.N35 |
1922042 | O=C1NCCCc2[nH]c(-c3nc(-c4ccccc4)n[nH]3)nc21 | [O][=C][N][C][C][C][C][NH1][C][Branch2][Ring1][C][C][=N][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][NH1][Ring1][O][=N][C][=Ring1][S][Ring2][Ring1][Branch1] | O=C1NCCCc2[nH]c5nc21.c15nc6n[nH]1.c16ccccc1 |
1922043 | CN(C)c1cnn(CCc2ccc(F)cc2)c(=O)c1 | [C][N][Branch1][C][C][C][C][=N][N][Branch1][=C][C][C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][C][=Ring1][S] | c13cnn4c(=O)c1.c15ccc(F)cc1.CN3C.C4C5 |
1922044 | COC(=O)CC1Oc2ccccc2N(Cc2cc(C(C)C)no2)C1=O | [C][O][C][=Branch1][C][=O][C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Branch1][S][C][C][=C][C][Branch1][=Branch1][C][Branch1][C][C][C][=N][O][Ring1][Branch2][C][Ring2][Ring1][Ring1][=O] | C14Oc2ccccc2N(C5)C1=O.c15cc6no1.C3(=O)C4.C6(C)C.CO3 |
1922045 | CCOc1ncccc1Cn1cc(-c2cncnc2)nn1 | [C][C][O][C][=N][C][=C][C][=C][Ring1][=Branch1][C][N][C][=C][Branch1][=Branch2][C][=C][N][=C][N][=C][Ring1][=Branch1][N][=N][Ring1][O] | c14ncccc16.n15cc7nn1.c17cncnc1.CC3.O34.C56 |
1922046 | CC(=O)NC1Cc2ccccc2C1Nc1nc(C)nc2c1cnn2C | [C][C][=Branch1][C][=O][N][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][=Branch2][N][C][=N][C][Branch1][C][C][=N][C][=C][Ring1][#Branch1][C][=N][N][Ring1][Branch1][C] | C15Cc2ccccc2C1N4.c14nc(C)nc2c1cnn2C.CC3=O.N35 |
1922047 | Cc1ccnc(N2CCC(c3nnc(-c4ccc(F)cc4)o3)CC2)n1 | [C][C][=C][C][=N][C][Branch2][Ring1][P][N][C][C][C][Branch2][Ring1][Branch1][C][=N][N][=C][Branch1][N][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][O][Ring1][N][C][C][Ring2][Ring1][C][=N][Ring2][Ring1][Branch2] | Cc1ccnc5n1.N15CCC6CC1.c17ccc(F)cc1.c16nnc7o1 |
1922048 | COc1ccc(-c2cn(CCN3CCc4ccccc43)nn2)cn1 | [C][O][C][=C][C][=C][Branch2][Ring1][=Branch2][C][=C][N][Branch1][S][C][C][N][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][=Branch2][N][=N][Ring1][S][C][=N][Ring2][Ring1][=Branch1] | N16CCc2ccccc21.c15ccc8cn1.c18cn7nn1.C7C6.CO5 |
1922049 | CCN(Cc1cnn(C)c1)C(=O)C(c1ccc(C)cc1)N(C)C | [C][C][N][Branch1][N][C][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][C][=Branch1][C][=O][C][Branch1][N][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1][N][Branch1][C][C][C] | c17ccc(C)cc1.c16cnn(C)c1.C2(=O)C57.N234.N5(C)C.CC3.C46 |
1922050 | Cc1ccc(-c2nc(Cn3ncn4cccc4c3=O)no2)cc1 | [C][C][=C][C][=C][Branch2][Ring1][=Branch2][C][=N][C][Branch1][S][C][N][N][=C][N][C][=C][C][=C][Ring1][Branch1][C][Ring1][=Branch2][=O][=N][O][Ring1][S][C][=C][Ring2][Ring1][=Branch1] | n15ncn2cccc2c1=O.Cc1ccc7cc1.c17nc6no1.C56 |
1922051 | COc1ccc2[nH]c(-c3nc4c([nH]3)CCCNC4=O)cc2c1 | [C][O][C][=C][C][=C][NH1][C][Branch2][Ring1][C][C][=N][C][=C][Branch1][Ring2][NH1][Ring1][Branch1][C][C][C][N][C][Ring1][Branch2][=O][=C][C][Ring1][S][=C][Ring2][Ring1][Ring2] | c16nc2c([nH]1)CCCNC2=O.c15ccc2[nH]c6cc2c1.CO5 |
1922052 | CCOCCn1nc(C)cc1C(=O)N(C)C1CCCc2ccccc21 | [C][C][O][C][C][N][N][=C][Branch1][C][C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Branch1][C][C][C][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][#Branch2] | N3(C)C1CCCc2ccccc21.n17nc(C)cc16.C5C7.C36=O.CC4.O45 |
1922054 | Cc1ncsc1Cc1nc2c([nH]1)CC(C)(C)CNC2=O | [C][C][N][=C][S][C][=Ring1][Branch1][C][C][=N][C][=C][Branch1][Ring2][NH1][Ring1][Branch1][C][C][Branch1][C][C][Branch1][C][C][C][N][C][Ring1][#Branch2][=O] | c14nc2c([nH]1)CC(C)(C)CNC2=O.Cc1ncsc13.C34 |
1922056 | Cc1cc(=O)[nH]c(CCNC(=O)C(c2ccccc2F)N(C)C)n1 | [C][C][=C][C][=Branch1][C][=O][NH1][C][Branch2][Ring1][=Branch2][C][C][N][C][=Branch1][C][=O][C][Branch1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][F][N][Branch1][C][C][C][=N][Ring2][Ring1][#Branch1] | Cc1cc(=O)[nH]c6n1.c17ccccc1F.C3(=O)C57.C6C4.N5(C)C.N34 |
1922057 | COc1cccc(-n2cc(CNc3nc(C)nc4ncccc34)cn2)c1 | [C][O][C][=C][C][=C][C][Branch2][Ring1][#C][N][C][=C][Branch2][Ring1][Ring2][C][N][C][=N][C][Branch1][C][C][=N][C][=N][C][=C][C][=C][Ring1][O][Ring1][=Branch1][C][=N][Ring2][Ring1][C][=C][Ring2][Ring1][Branch2] | c17nc(C)nc2ncccc12.c15cccc9c1.n19cc8cn1.CO5.C68.N67 |
1922058 | c1nc(N2CCCC3(CCOC3)C2)c2sccc2n1 | [C][=N][C][Branch1][P][N][C][C][C][C][Branch1][#Branch1][C][C][O][C][Ring1][Branch1][C][Ring1][#Branch2][=C][S][C][=C][C][Ring1][Branch1][=N][Ring2][Ring1][Ring1] | N14CCCC2(CCOC2)C1.c1nc4c2sccc2n1 |
1922059 | CSc1ccc(CNC(=O)C(c2ccccc2C)N(C)C)cc1 | [C][S][C][=C][C][=C][Branch2][Ring1][Branch2][C][N][C][=Branch1][C][=O][C][Branch1][#Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][N][Branch1][C][C][C][C][=C][Ring2][Ring1][Branch1] | c18ccc6cc1.c17ccccc1C.C3(=O)C57.N5(C)C.CS8.C46.N34 |
1922060 | O=C1COc2cccnc2N1CCn1cnc2ccccc21 | [O][=C][C][O][C][=C][C][=C][N][=C][Ring1][=Branch1][N][Ring1][#Branch2][C][C][N][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][Ring1][=Branch2] | O=C1COc2cccnc2N1CC3.n13cnc2ccccc21 |
1922061 | CCC(Nc1cc(C)nc(Nc2cccc(O)c2)n1)c1nccs1 | [C][C][C][Branch2][Ring1][O][N][C][=C][C][Branch1][C][C][=N][C][Branch1][=N][N][C][=C][C][=C][C][Branch1][C][O][=C][Ring1][#Branch1][=N][Ring1][#C][C][=N][C][=C][S][Ring1][Branch1] | c14cc(C)nc5n1.c16cccc(O)c1.c17nccs1.CCC37.N34.N56 |
1922063 | CCc1c(C)nn(CCNc2ncnc3nc(C)cc(C)c23)c1C | [C][C][C][C][Branch1][C][C][=N][N][Branch2][Ring1][Branch2][C][C][N][C][=N][C][=N][C][=N][C][Branch1][C][C][=C][C][Branch1][C][C][=C][Ring1][N][Ring1][Branch2][C][=Ring2][Ring1][Branch1][C] | c15ncnc2nc(C)cc(C)c12.c17c(C)nn6c1C.C6C4.CC7.N45 |
1922064 | COc1ccccc1C1CNC(=O)c2nc(-c3cccnc3)[nH]c2C1 | [C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][N][C][=Branch1][C][=O][C][N][=C][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][NH1][C][=Ring1][O][C][Ring1][P] | C16CNC(=O)c2nc5[nH]c2C1.c14ccccc16.c15cccnc1.CO4 |
1922065 | Cc1nc(NCc2ccsc2)c2c(C)noc2n1 | [C][C][=N][C][Branch1][#Branch2][N][C][C][C][=C][S][C][=Ring1][Branch1][=C][C][Branch1][C][C][=N][O][C][Ring1][=Branch1][=N][Ring1][P] | Cc1nc4c2c(C)noc2n1.c15ccsc1.N34.C35 |
1922066 | O=C(C1CC1)N1CCC(C(=O)N2CC(c3cccnc3)C2)CC1 | [O][=C][Branch1][=Branch1][C][C][C][Ring1][Ring1][N][C][C][C][Branch2][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][C][Ring1][#Branch2][C][C][Ring2][Ring1][C] | N14CCC7CC1.c18cccnc1.N15CC8C1.O=C46.C16CC1.C57=O |
1922067 | O=C(C(c1cccnc1)N1CCCC1)N1CCn2cccc2C1 | [O][=C][Branch2][Ring1][Ring1][C][Branch1][=Branch2][C][=C][C][=C][N][=C][Ring1][=Branch1][N][C][C][C][C][Ring1][Branch1][N][C][C][N][C][=C][C][=C][Ring1][Branch1][C][Ring1][=Branch2] | N13CCn2cccc2C1.c15cccnc1.O=C3C45.N14CCCC1 |
1922068 | CCCc1noc(-c2cnc(-c3ccncc3)nc2)n1 | [C][C][C][C][=N][O][C][Branch2][Ring1][Ring1][C][=C][N][=C][Branch1][=Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][N][=C][Ring1][N][=N][Ring1][P] | c15cnc6nc1.c14noc5n1.c16ccncc1.CCC4 |
1922069 | Cc1c(Cl)cc(C(=O)N2CCC3(CC2)CNC(=O)O3)cc1Cl | [C][C][=C][Branch1][C][Cl][C][=C][Branch2][Ring1][Branch2][C][=Branch1][C][=O][N][C][C][C][Branch1][Branch1][C][C][Ring1][=Branch1][C][N][C][=Branch1][C][=O][O][Ring1][Branch2][C][=C][Ring2][Ring1][Ring2][Cl] | N14CCC2(CC1)CNC(=O)O2.Cc1c(Cl)cc5cc1Cl.C45=O |
1922070 | Cc1ccccc1OC1CN(C(=O)CCCc2cn[nH]c2)C1 | [C][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][C][N][Branch1][#C][C][=Branch1][C][=O][C][C][C][C][C][=N][NH1][C][=Ring1][Branch1][C][Ring1][=C] | Cc1ccccc15.C3(=O)CCC6.C14CN3C1.c16cn[nH]c1.O45 |
1922071 | CN(C)c1nc(NC(CO)Cc2ccc(Cl)cc2)ncc1F | [C][N][Branch1][C][C][C][=N][C][Branch2][Ring1][Ring1][N][C][Branch1][Ring1][C][O][C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][=N][C][=C][Ring2][Ring1][C][F] | c14nc5ncc1F.c16ccc(Cl)cc1.C3(C6)CO.CN4C.N35 |
1922072 | CC(C)=CCN1C(=O)C2CCC1CN(C(=O)c1ccnc(N)c1)C2 | [C][C][Branch1][C][C][=C][C][N][C][=Branch1][C][=O][C][C][C][C][Ring1][#Branch1][C][N][Branch1][S][C][=Branch1][C][=O][C][=C][C][=N][C][Branch1][C][N][=C][Ring1][#Branch1][C][Ring1][S] | N16C(=O)C2CCC1CN3C2.c14ccnc(N)c1.CC=5C.C=5C6.C34=O |
1922073 | Cc1nnc(C(C)NC(=O)c2cc(Cl)c(C)c(Cl)c2)o1 | [C][C][=N][N][=C][Branch2][Ring1][O][C][Branch1][C][C][N][C][=Branch1][C][=O][C][=C][C][Branch1][C][Cl][=C][Branch1][C][C][C][Branch1][C][Cl][=C][Ring1][=Branch2][O][Ring2][Ring1][Ring1] | c15cc(Cl)c(C)c(Cl)c1.Cc1nnc6o1.C46C.C35=O.N34 |
1922074 | COCCN1CCCC2(CCN(c3nc(C)c(C)cc3C#N)C2)C1=O | [C][O][C][C][N][C][C][C][C][Branch2][Ring1][=Branch2][C][C][N][Branch1][P][C][=N][C][Branch1][C][C][=C][Branch1][C][C][C][=C][Ring1][Branch2][C][#N][C][Ring1][#C][C][Ring2][Ring1][Ring2][=O] | N16CCCC2(CCN5C2)C1=O.c15nc(C)c(C)cc1C#N.C4C6.CO4 |
1922075 | O=c1cnc2ccccc2n1CCS(=O)(=O)c1ccccc1 | [O][=C][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Ring1][#Branch2][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1] | O=c1cnc2ccccc2n13.C3CS(=O)(=O)c1ccccc1 |
1922076 | COCC(=O)N1CCC(C(=O)NCc2cnc(C)cn2)CC1 | [C][O][C][C][=Branch1][C][=O][N][C][C][C][Branch2][Ring1][C][C][=Branch1][C][=O][N][C][C][=C][N][=C][Branch1][C][C][C][=N][Ring1][#Branch1][C][C][Ring1][P] | N13CCC7CC1.c18cnc(C)cn1.C5C3=O.C47=O.CO5.N46.C68 |
1922077 | Cc1cc(CC2COCC2NC(=O)c2ccc3c(c2)OCCO3)on1 | [C][C][C][=C][Branch2][Ring1][=C][C][C][C][O][C][C][Ring1][Branch1][N][C][=Branch1][C][=O][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][C][O][Ring1][#Branch1][O][N][=Ring2][Ring1][Branch2] | c16ccc2c(c1)OCCO2.Cc1cc7on1.C18COCC15.C46=O.C78.N45 |
1922078 | Cc1ncc(S(C)(=O)=O)c(N(C)Cc2ccc(C)s2)n1 | [C][C][=N][C][=C][Branch1][=Branch2][S][Branch1][C][C][=Branch1][C][=O][=O][C][Branch1][S][N][Branch1][C][C][C][C][=C][C][=C][Branch1][C][C][S][Ring1][=Branch1][=N][Ring2][Ring1][Ring1] | Cc1ncc(S(C)(=O)=O)c4n1.c15ccc(C)s1.N34C.C35 |
1922079 | O=C(NC1CCOCC1)C1CC(=O)N(Cc2cccnc2)C1 | [O][=C][Branch1][#Branch2][N][C][C][C][O][C][C][Ring1][=Branch1][C][C][C][=Branch1][C][=O][N][Branch1][#Branch2][C][C][=C][C][=C][N][=C][Ring1][=Branch1][C][Ring1][=N] | C15CC(=O)N6C1.C14CCOCC1.c17cccnc1.O=C35.N34.C67 |
1922080 | CCn1nc(CC(C)C)cc1-c1nc(C(C)C)no1 | [C][C][N][N][=C][Branch1][#Branch1][C][C][Branch1][C][C][C][C][=C][Ring1][=Branch2][C][=N][C][Branch1][=Branch1][C][Branch1][C][C][C][=N][O][Ring1][Branch2] | n12nc3cc15.c15nc4no1.C3C(C)C.C4(C)C.CC2 |
1922081 | Cc1ccccc1C(C(=O)NCCCc1c(C)noc1C)N(C)C | [C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch2][Ring1][Ring2][C][=Branch1][C][=O][N][C][C][C][C][C][Branch1][C][C][=N][O][C][=Ring1][=Branch1][C][N][Branch1][C][C][C] | Cc1ccccc15.c16c(C)noc1C.C35C2=O.C4CC6.N3(C)C.N24 |
1922083 | Cc1nc2ccccc2n(Cc2ncccn2)c1=O | [C][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Branch1][#Branch2][C][C][=N][C][=C][C][=N][Ring1][=Branch1][C][Ring1][P][=O] | Cc1nc2ccccc2n3c1=O.c14ncccn1.C34 |
1922084 | Cc1noc(C)c1C(=O)NCC1CCOc2ccccc2C1 | [C][C][=N][O][C][Branch1][C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][O] | C16CCOc2ccccc2C1.Cc1noc(C)c15.C35=O.N34.C46 |
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