ID large_stringlengths 1 7 | smiles stringlengths 15 57 | selfies stringlengths 55 294 | safe stringlengths 15 83 |
|---|---|---|---|
1925913 | COc1cccc(NC(=O)NC2CCN(C3CCOC3=O)CC2)c1 | [C][O][C][=C][C][=C][C][Branch2][Ring1][=Branch2][N][C][=Branch1][C][=O][N][C][C][C][N][Branch1][=Branch2][C][C][C][O][C][Ring1][Branch1][=O][C][C][Ring1][N][=C][Ring2][Ring1][=Branch1] | c16cccc7c1.C18CCN9CC1.C19CCOC1=O.C45=O.CO6.N47.N58 |
1925914 | Cn1ccnc1C(=O)N1CCC(C(C)(C)C)C(O)C1 | [C][N][C][=C][N][=C][Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][Branch1][C][O][C][Ring1][O] | N12CCC4C(O)C1.Cn1ccnc13.C4(C)(C)C.C23=O |
1925915 | CC1CC1C(=O)NCc1nc2ccccc2c(=O)n1C | [C][C][C][C][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][=N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][Ring1][O][C] | c16nc2ccccc2c(=O)n1C.CC1CC15.C35=O.N34.C46 |
1925916 | CCc1nc(CC(=O)NCc2nnc(C)n2C2CC2)cs1 | [C][C][C][=N][C][Branch2][Ring1][#Branch1][C][C][=Branch1][C][=O][N][C][C][=N][N][=C][Branch1][C][C][N][Ring1][=Branch1][C][C][C][Ring1][Ring1][=C][S][Ring2][Ring1][Ring1] | c17nnc(C)n18.c15nc6cs1.C6C3=O.C18CC1.CC5.N34.C47 |
1925917 | Cn1cnc2cc(C(=O)Nc3cccc(-c4nc[nH]n4)c3)cnc21 | [C][N][C][=N][C][=C][C][Branch2][Ring1][#Branch1][C][=Branch1][C][=O][N][C][=C][C][=C][C][Branch1][Branch2][C][N][=C][NH1][N][=Ring1][Branch1][=C][Ring1][O][=C][N][=C][Ring2][Ring1][Ring2][Ring2][Ring1][#Branch1] | Cn1cnc2cc7cnc21.c16cccc8c1.c18nc[nH]n1.C57=O.N56 |
1925918 | COc1ccc(OC)c2c1CN(Cc1cc(C)c(O)cc1C)CC2O | [C][O][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2][C][N][Branch1][P][C][C][=C][C][Branch1][C][C][=C][Branch1][C][O][C][=C][Ring1][Branch2][C][C][C][Ring1][S][O] | c13ccc4c2c1CN5CC2O.c16cc(C)c(O)cc1C.CO3.O4C.C56 |
1925919 | c1cc(NC(c2nccs2)C2CC2)nc(N2CCOCC2)n1 | [C][=C][C][Branch1][P][N][C][Branch1][Branch2][C][=N][C][=C][S][Ring1][Branch1][C][C][C][Ring1][Ring1][=N][C][Branch1][=Branch2][N][C][C][O][C][C][Ring1][=Branch1][=N][Ring2][Ring1][=Branch1] | c1cc4nc5n1.N15CCOCC1.c16nccs1.C367.C17CC1.N34 |
1925921 | O=C(CCCc1cccs1)NC1(CCO)CCOCC1 | [O][=C][Branch1][O][C][C][C][C][=C][C][=C][S][Ring1][Branch1][N][C][Branch1][Ring2][C][C][O][C][C][O][C][C][Ring1][=Branch2] | C135CCOCC1.O=C2CCC4.c14cccs1.C5CO.N23 |
1925922 | CS(=O)(=O)c1nc(C(=O)OCc2cncs2)c2ccccn12 | [C][S][=Branch1][C][=O][=Branch1][C][=O][C][=N][C][Branch1][=C][C][=Branch1][C][=O][O][C][C][=C][N][=C][S][Ring1][Branch1][=C][C][=C][C][=C][N][Ring2][Ring1][C][Ring1][=Branch1] | CS(=O)(=O)c1nc5c2ccccn12.c16cncs1.C35=O.O34.C46 |
1925923 | Cc1ccsc1C(=O)Oc1cncc(C(N)=O)c1 | [C][C][C][=C][S][C][=Ring1][Branch1][C][=Branch1][C][=O][O][C][=C][N][=C][C][Branch1][=Branch1][C][Branch1][C][N][=O][=C][Ring1][=Branch2] | c13cncc5c1.Cc1ccsc14.C24=O.C5(N)=O.O23 |
1925924 | Cc1nn(C(C)(C)C)c(=O)n1CCOc1ccccc1C#N | [C][C][=N][N][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][Ring1][#Branch2][C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][#N] | Cc1nn4c(=O)n15.c13ccccc1C#N.C4(C)(C)C.C5C2.O23 |
1925925 | Cc1ccc(C(=O)NCC(O)C2CCCC2)cc1O | [C][C][=C][C][=C][Branch2][Ring1][C][C][=Branch1][C][=O][N][C][C][Branch1][C][O][C][C][C][C][C][Ring1][Branch1][C][=C][Ring1][P][O] | Cc1ccc5cc1O.C16CCCC1.C4C6O.C35=O.N34 |
1925926 | O=C(CSc1ccc(Cl)cc1)N1CC(n2ccnn2)C1 | [O][=C][Branch1][=C][C][S][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][N][C][C][Branch1][Branch2][N][C][=C][N][=N][Ring1][Branch1][C][Ring1][=Branch2] | c16ccc(Cl)cc1.N13CC5C1.n15ccnn1.O=C3C4.S46 |
1925927 | O=C(C(c1ccccc1)c1ccccc1)N1CC(n2ccnn2)C1 | [O][=C][Branch2][Ring1][Ring2][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][C][Branch1][Branch2][N][C][=C][N][=N][Ring1][Branch1][C][Ring1][=Branch2] | c14ccccc1.c15ccccc1.O=C3C45.N13CC6C1.n16ccnn1 |
1925929 | Cc1c(C(=O)N2CC(n3cc(-c4ccccc4)nn3)C2)cnn1C | [C][C][=C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][C][N][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=N][Ring1][O][C][Ring1][#C][C][=N][N][Ring2][Ring1][=Branch1][C] | Cc1c6cnn1C.n17cc8nn1.c18ccccc1.N15CC7C1.C56=O |
1925930 | CCn1cc(C(=O)N2CC(n3cc(-c4ccccc4)nn3)C2)cn1 | [C][C][N][C][=C][Branch2][Ring1][#C][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][C][N][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=N][Ring1][O][C][Ring1][#C][C][=N][Ring2][Ring1][=Branch1] | n17cc6cn1.n18cc9nn1.c19ccccc1.N15CC8C1.C56=O.CC7 |
1925931 | Cc1nn(C)cc1C(=O)N1CC(n2cc(-c3ccccc3)nn2)C1 | [C][C][=N][N][Branch1][C][C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][C][N][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=N][Ring1][O][C][Ring1][#C] | Cc1nn(C)cc15.n16cc7nn1.c17ccccc1.N14CC6C1.C45=O |
1925932 | Cc1nn(C)c(C)c1C(=O)N1CC(n2cc(-c3ccccc3)nn2)C1 | [C][C][=N][N][Branch1][C][C][C][Branch1][C][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][C][N][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=N][Ring1][O][C][Ring1][#C] | Cc1nn(C)c(C)c15.n16cc7nn1.c17ccccc1.N14CC6C1.C45=O |
1925933 | Cc1cc(CC(=O)N2CC(n3cc(-c4ccccc4)nn3)C2)no1 | [C][C][=C][C][Branch2][Ring1][S][C][C][=Branch1][C][=O][N][C][C][Branch2][Ring1][C][N][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=N][Ring1][O][C][Ring1][#C][=N][O][Ring2][Ring1][#Branch1] | Cc1cc6no1.n17cc8nn1.c18ccccc1.N15CC7C1.C6C5=O |
1925934 | O=C(c1ccoc1)N1CC(n2cc(-c3ccccc3)nn2)C1 | [O][=C][Branch1][Branch2][C][C][=C][O][C][=Ring1][Branch1][N][C][C][Branch2][Ring1][C][N][C][=C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=N][Ring1][O][C][Ring1][#C] | n16cc7nn1.c17ccccc1.c15ccoc1.N14CC6C1.O=C45 |
1925937 | O=C(NC1CCc2nnc(Cc3ccccc3)n2C1)c1ccccc1 | [O][=C][Branch2][Ring1][#Branch2][N][C][C][C][C][=N][N][=C][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Ring1][N][C][Ring1][S][C][=C][C][=C][C][=C][Ring1][=Branch1] | C15CCc2nnc7n2C1.c18ccccc1.c16ccccc1.O=C46.N45.C78 |
1925938 | CC(C)(C)C(=O)NC1CCc2nnc(Cc3ccccc3)n2C1 | [C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][C][=N][N][=C][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Ring1][N][C][Ring1][S] | C15CCc2nnc6n2C1.CC(C)(C)C4=O.c17ccccc1.N45.C67 |
1925939 | CC(C)CC(=O)NC1CCc2nnc(Cc3ccccc3)n2C1 | [C][C][Branch1][C][C][C][C][=Branch1][C][=O][N][C][C][C][C][=N][N][=C][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Ring1][N][C][Ring1][S] | C15CCc2nnc6n2C1.CC(C)CC4=O.c17ccccc1.N45.C67 |
1925940 | Cc1nn(Cc2ccccc2)c(C)c1C1COCCN1C(=O)C1CC1 | [C][C][=N][N][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][C][=C][Ring1][=N][C][C][O][C][C][N][Ring1][=Branch1][C][=Branch1][C][=O][C][C][C][Ring1][Ring1] | Cc1nn5c(C)c17.C17COCCN13.c16ccccc1.C34=O.C14CC1.C56 |
1925941 | Cc1occc1C(=O)N1CCCC(S(=O)(=O)N2CCOCC2)C1 | [C][C][O][C][=C][C][=Ring1][Branch1][C][=Branch1][C][=O][N][C][C][C][C][Branch1][S][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][O][C][C][Ring1][=Branch1][C][Ring1][#C] | N13CCCC(S4(=O)=O)C1.Cc1occc15.N14CCOCC1.C35=O |
1925942 | CC(C)c1nnc2n1CC(NC(=O)NC1CCCCC1)CC2 | [C][C][Branch1][C][C][C][=N][N][=C][N][Ring1][Branch1][C][C][Branch1][#C][N][C][=Branch1][C][=O][N][C][C][C][C][C][C][Ring1][=Branch1][C][C][Ring1][S] | c17nnc2n1CC5CC2.C16CCCCC1.CC7C.C34=O.N35.N46 |
1925943 | C#CCNC(=O)NC1CCc2nnc(Cc3ccccc3)n2C1 | [C][#C][C][N][C][=Branch1][C][=O][N][C][C][C][C][=N][N][=C][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Ring1][N][C][Ring1][S] | C17CCc2nnc8n2C1.c19ccccc1.C#CC6.C45=O.N46.N57.C89 |
1925944 | CCNC(=O)NC1CCc2nnc(Cc3ccccc3)n2C1 | [C][C][N][C][=Branch1][C][=O][N][C][C][C][C][=N][N][=C][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Ring1][N][C][Ring1][S] | C17CCc2nnc8n2C1.c19ccccc1.C45=O.CC6.N46.N57.C89 |
1925945 | Cc1occc1-c1nc(C2CN(C(C)C)CCO2)no1 | [C][C][O][C][=C][C][=Ring1][Branch1][C][=N][C][Branch1][S][C][C][N][Branch1][=Branch1][C][Branch1][C][C][C][C][C][O][Ring1][=Branch2][=N][O][Ring1][=C] | C14CN3CCO1.Cc1occc15.c15nc4no1.C3(C)C |
1925946 | CC(C)c1cc(C(=O)N2CC(S(=O)(=O)N3CCOCC3)C2)on1 | [C][C][Branch1][C][C][C][C][=C][Branch2][Ring1][N][C][=Branch1][C][=O][N][C][C][Branch1][S][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][O][C][C][Ring1][=Branch1][C][Ring1][=N][O][N][=Ring2][Ring1][Ring2] | N14CC(S5(=O)=O)C1.c17cc6on1.N15CCOCC1.CC7C.C46=O |
1925947 | COc1ncccc1C(=O)N1CC(S(=O)(=O)N2CCOCC2)C1 | [C][O][C][=N][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][N][C][C][Branch1][S][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][O][C][C][Ring1][=Branch1][C][Ring1][=N] | N13CC(S5(=O)=O)C1.c14ncccc16.N15CCOCC1.C36=O.CO4 |
1925948 | COc1ccc(C(=O)N2CC(S(=O)(=O)N3CCOCC3)C2)cn1 | [C][O][C][=C][C][=C][Branch2][Ring1][N][C][=Branch1][C][=O][N][C][C][Branch1][S][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][O][C][C][Ring1][=Branch1][C][Ring1][=N][C][=N][Ring2][Ring1][Branch1] | N14CC(S6(=O)=O)C1.c15ccc7cn1.N16CCOCC1.C47=O.CO5 |
1925949 | Cc1ccc(C(=O)N2CC(S(=O)(=O)N3CCOCC3)C2)cn1 | [C][C][=C][C][=C][Branch2][Ring1][N][C][=Branch1][C][=O][N][C][C][Branch1][S][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][O][C][C][Ring1][=Branch1][C][Ring1][=N][C][=N][Ring2][Ring1][Branch1] | N14CC(S5(=O)=O)C1.Cc1ccc6cn1.N15CCOCC1.C46=O |
1925950 | O=C(c1cc(C2CC2)[nH]n1)N1CC(S(=O)(=O)N2CCOCC2)C1 | [O][=C][Branch1][#C][C][C][=C][Branch1][=Branch1][C][C][C][Ring1][Ring1][NH1][N][=Ring1][Branch2][N][C][C][Branch1][S][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][O][C][C][Ring1][=Branch1][C][Ring1][=N] | N13CC(S4(=O)=O)C1.c15cc6[nH]n1.N14CCOCC1.O=C35.C16CC1 |
1925951 | Cc1ccc(NCc2c[nH]nc2-c2ccccc2)cc1S(C)(=O)=O | [C][C][=C][C][=C][Branch2][Ring1][C][N][C][C][=C][NH1][N][=C][Ring1][Branch1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][Ring1][S][Branch1][C][C][=Branch1][C][=O][=O] | Cc1ccc4cc1S(C)(=O)=O.c15c[nH]nc16.c16ccccc1.N34.C35 |
1925952 | CC(O)c1cn(C2CN(c3ncc(C(F)(F)F)cc3Cl)C2)nn1 | [C][C][Branch1][C][O][C][=C][N][Branch2][Ring1][=N][C][C][N][Branch2][Ring1][Ring2][C][=N][C][=C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][#Branch2][Cl][C][Ring1][#C][N][=N][Ring2][Ring1][Ring2] | c14ncc6cc1Cl.c15cn7nn1.C17CN4C1.C6(F)(F)F.CC5O |
1925953 | N#CCCCN1CCN(C2CCCN(c3ccccc3)C2=O)CC1 | [N][#C][C][C][C][N][C][C][N][Branch2][Ring1][Ring2][C][C][C][C][N][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][N][=O][C][C][Ring2][Ring1][Ring1] | C15CCCN6C1=O.N14CCN5CC1.c16ccccc1.N#CCCC4 |
1925955 | c1ccc(-c2nc(C3CN(Cc4ccccn4)CCO3)no2)cc1 | [C][=C][C][=C][Branch2][Ring1][#C][C][=N][C][Branch2][Ring1][Ring2][C][C][N][Branch1][#Branch2][C][C][=C][C][=C][C][=N][Ring1][=Branch1][C][C][O][Ring1][=N][=N][O][Ring2][Ring1][C][C][=C][Ring2][Ring1][Branch2] | C17CN5CCO1.c1ccc8cc1.c18nc7no1.c16ccccn1.C56 |
1925956 | CC(C)N(C)S(=O)(=O)N1CCN(C(C#N)c2ccccc2)CC1 | [C][C][Branch1][C][C][N][Branch1][C][C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][N][Branch1][=C][C][Branch1][Ring1][C][#N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][#C] | N3(C)S(=O)(=O)N1CCN4CC1.c15ccccc1.C45C#N.CC3C |
1925957 | CCN(C)S(=O)(=O)N1CCN(C(C#N)c2ccccc2)CC1 | [C][C][N][Branch1][C][C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][N][Branch1][=C][C][Branch1][Ring1][C][#N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][#C] | N3(C)S(=O)(=O)N1CCN4CC1.c15ccccc1.C45C#N.CC3 |
1925958 | CC(=O)Nc1cn[nH]c1C1CCCN(Cc2csc(C(C)C)n2)C1 | [C][C][=Branch1][C][=O][N][C][C][=N][NH1][C][=Ring1][Branch1][C][C][C][C][N][Branch1][S][C][C][=C][S][C][Branch1][=Branch1][C][Branch1][C][C][C][=N][Ring1][Branch2][C][Ring1][#C] | C18CCCN4C1.c15cn[nH]c18.c16csc7n1.CC3=O.C7(C)C.N35.C46 |
1925959 | Cc1ccncc1NC(=O)N1CC(S(=O)(=O)N2CCOCC2)C1 | [C][C][=C][C][=N][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=O][N][C][C][Branch1][S][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][O][C][C][Ring1][=Branch1][C][Ring1][=N] | N14CC(S5(=O)=O)C1.Cc1ccncc16.N15CCOCC1.C34=O.N36 |
1925960 | CN(C1CCC1)S(=O)(=O)C1CCCN(C(=O)c2ccccc2)C1 | [C][N][Branch1][#Branch1][C][C][C][C][Ring1][Ring2][S][=Branch1][C][=O][=Branch1][C][=O][C][C][C][C][N][Branch1][=N][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Ring1][=C] | S4(=O)(=O)C1CCCN3C1.c16ccccc1.C15CCC1.CN45.C36=O |
1925961 | Cc1ccc2c(c1)N(C(=O)N1CCOCC1)CC(C)O2 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][N][Branch1][=N][C][=Branch1][C][=O][N][C][C][O][C][C][Ring1][=Branch1][C][C][Branch1][C][C][O][Ring1][S] | Cc1ccc2c(c1)N3CC(C)O2.N14CCOCC1.C34=O |
1925962 | Cc1ccc2c(c1)OC(C)CN2C(=O)N1CCOCC1 | [C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][O][C][Branch1][C][C][C][N][Ring1][Branch2][C][=Branch1][C][=O][N][C][C][O][C][C][Ring1][=Branch1] | Cc1ccc2c(c1)OC(C)CN23.N14CCOCC1.C34=O |
1925964 | O=S(=O)(c1ccc(Cl)c(Cl)c1)N1CC(n2ccnn2)C1 | [O][=S][=Branch1][C][=O][Branch1][#C][C][=C][C][=C][Branch1][C][Cl][C][Branch1][C][Cl][=C][Ring1][Branch2][N][C][C][Branch1][Branch2][N][C][=C][N][=N][Ring1][Branch1][C][Ring1][=Branch2] | O=S3(=O)c1ccc(Cl)c(Cl)c1.N13CC4C1.n14ccnn1 |
1925965 | Cc1ccc(Cl)cc1S(=O)(=O)N1CC(n2ccnn2)C1 | [C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][Branch1][Branch2][N][C][=C][N][=N][Ring1][Branch1][C][Ring1][=Branch2] | Cc1ccc(Cl)cc1S3(=O)=O.N13CC4C1.n14ccnn1 |
1925966 | O=S(=O)(c1cccc(OC(F)(F)F)c1)N1CC(n2ccnn2)C1 | [O][=S][=Branch1][C][=O][Branch2][Ring1][Ring2][C][=C][C][=C][C][Branch1][#Branch2][O][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][O][N][C][C][Branch1][Branch2][N][C][=C][N][=N][Ring1][Branch1][C][Ring1][=Branch2] | O=S4(=O)c1cccc3c1.O3C(F)(F)F.N14CC5C1.n15ccnn1 |
1925967 | O=S(=O)(c1ccc(OC(F)(F)F)cc1)N1CC(n2ccnn2)C1 | [O][=S][=Branch1][C][=O][Branch2][Ring1][Ring2][C][=C][C][=C][Branch1][#Branch2][O][C][Branch1][C][F][Branch1][C][F][F][C][=C][Ring1][O][N][C][C][Branch1][Branch2][N][C][=C][N][=N][Ring1][Branch1][C][Ring1][=Branch2] | O=S4(=O)c1ccc3cc1.O3C(F)(F)F.N14CC5C1.n15ccnn1 |
1925968 | CCOc1ccc(S(=O)(=O)NC2CCc3nnc(C)n3C2)cc1 | [C][C][O][C][=C][C][=C][Branch2][Ring1][=Branch2][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][C][=N][N][=C][Branch1][C][C][N][Ring1][=Branch1][C][Ring1][#Branch2][C][=C][Ring2][Ring1][Ring2] | c15ccc(S6(=O)=O)cc1.C17CCc2nnc(C)n2C1.CC4.O45.N67 |
1925969 | CC(C)c1nnc2n1CC(NS(=O)(=O)c1ccccc1)CC2 | [C][C][Branch1][C][C][C][=N][N][=C][N][Ring1][Branch1][C][C][Branch1][P][N][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][C][Ring1][S] | c15nnc2n1CC4CC2.S3(=O)(=O)c1ccccc1.CC5C.N34 |
1925970 | CCCS(=O)(=O)NC1CCc2nnc(Cc3ccccc3)n2C1 | [C][C][C][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][C][=N][N][=C][Branch1][#Branch2][C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][Ring1][N][C][Ring1][S] | C15CCc2nnc6n2C1.CCCS4(=O)=O.c17ccccc1.N45.C67 |
1925971 | Cc1nc(C2CCCCCN2C(=O)Nc2ccccn2)no1 | [C][C][=N][C][Branch2][Ring1][#Branch1][C][C][C][C][C][C][N][Ring1][#Branch1][C][=Branch1][C][=O][N][C][=C][C][=C][C][=N][Ring1][=Branch1][=N][O][Ring2][Ring1][Branch1] | C16CCCCCN13.Cc1nc6no1.c15ccccn1.C34=O.N45 |
1925972 | CCCOc1ccc(N(Cc2cc(C)no2)S(C)(=O)=O)cc1 | [C][C][C][O][C][=C][C][=C][Branch2][Ring1][#Branch1][N][Branch1][N][C][C][=C][C][Branch1][C][C][=N][O][Ring1][=Branch1][S][Branch1][C][C][=Branch1][C][=O][=O][C][=C][Ring2][Ring1][C] | c14ccc7cc1.c18cc(C)no1.S6(C)(=O)=O.CCC3.N567.O34.C58 |
1925973 | Cc1nc(C2CN(C(=O)c3csc4c3CCCC4)CCO2)no1 | [C][C][=N][C][Branch2][Ring1][=N][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][S][C][=C][Ring1][Branch1][C][C][C][C][Ring1][=Branch1][C][C][O][Ring1][P][=N][O][Ring2][Ring1][=Branch1] | c16csc2c1CCCC2.C17CN5CCO1.Cc1nc7no1.C56=O |
1925974 | Cc1nc(C2CN(C(=O)c3csc4ccccc34)CCO2)no1 | [C][C][=N][C][Branch2][Ring1][=N][C][C][N][Branch2][Ring1][C][C][=Branch1][C][=O][C][=C][S][C][=C][C][=C][C][=C][Ring1][=Branch2][Ring1][=Branch1][C][C][O][Ring1][P][=N][O][Ring2][Ring1][=Branch1] | c16csc2ccccc12.C17CN5CCO1.Cc1nc7no1.C56=O |
1925975 | O=C(C1CCCC1)N1CCOC(c2noc(-c3ccccc3)n2)C1 | [O][=C][Branch1][Branch2][C][C][C][C][C][Ring1][Branch1][N][C][C][O][C][Branch2][Ring1][C][C][=N][O][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][Ring1][O][C][Ring1][P] | N14CCOC6C1.c16noc7n1.c17ccccc1.C15CCCC1.O=C45 |
1925976 | Cc1nc(C)c(C(=O)N2CCOCC2c2noc(C(C)C)n2)s1 | [C][C][=N][C][Branch1][C][C][=C][Branch2][Ring1][O][C][=Branch1][C][=O][N][C][C][O][C][C][Ring1][=Branch1][C][=N][O][C][Branch1][=Branch1][C][Branch1][C][C][C][=N][Ring1][Branch2][S][Ring2][Ring1][=Branch1] | Cc1nc(C)c4s1.N13CCOCC16.c16noc5n1.C34=O.C5(C)C |
1925977 | O=C(c1ccncc1)N1CCOCC1c1noc(-c2ccccc2)n1 | [O][=C][Branch1][=Branch2][C][=C][C][=N][C][=C][Ring1][=Branch1][N][C][C][O][C][C][Ring1][=Branch1][C][=N][O][C][Branch1][=Branch2][C][=C][C][=C][C][=C][Ring1][=Branch1][=N][Ring1][O] | N13CCOCC15.c14ccncc1.c15noc6n1.c16ccccc1.O=C34 |
1925979 | Cc1nc(C2CCCCCN2C(=O)c2ccccn2)no1 | [C][C][=N][C][Branch2][Ring1][=Branch1][C][C][C][C][C][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C][=C][C][=C][C][=N][Ring1][=Branch1][=N][O][Ring2][Ring1][Ring2] | C15CCCCCN13.Cc1nc5no1.c14ccccn1.C34=O |
1925980 | COc1cccc(C(=O)N2CCCCCC2c2noc(C)n2)n1 | [C][O][C][=C][C][=C][C][Branch2][Ring1][Branch2][C][=Branch1][C][=O][N][C][C][C][C][C][C][Ring1][#Branch1][C][=N][O][C][Branch1][C][C][=N][Ring1][=Branch1][=N][Ring2][Ring1][Branch1] | N13CCCCCC16.c14cccc5n1.c16noc(C)n1.C35=O.CO4 |
1925981 | CC(C)c1nc(C2CCCCCN2C(=O)c2cnccn2)no1 | [C][C][Branch1][C][C][C][=N][C][Branch2][Ring1][=Branch1][C][C][C][C][C][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C][=C][N][=C][C][=N][Ring1][=Branch1][=N][O][Ring2][Ring1][Ring2] | C16CCCCCN13.c15nc6no1.c14cnccn1.CC5C.C34=O |
1925982 | CC(C)c1nc(C2CCCCCN2C(=O)c2nccnc2N)no1 | [C][C][Branch1][C][C][C][=N][C][Branch2][Ring1][#Branch1][C][C][C][C][C][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C][=N][C][=C][N][=C][Ring1][=Branch1][N][=N][O][Ring2][Ring1][Branch1] | C16CCCCCN13.c14nccnc1N.c15nc6no1.CC5C.C34=O |
1925983 | CC(C)c1nc(C2CCCCCN2C(=O)c2ccccn2)no1 | [C][C][Branch1][C][C][C][=N][C][Branch2][Ring1][=Branch1][C][C][C][C][C][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C][=C][C][=C][C][=N][Ring1][=Branch1][=N][O][Ring2][Ring1][Ring2] | C16CCCCCN13.c15nc6no1.c14ccccn1.CC5C.C34=O |
1925984 | CC(C)c1nc(C2CCCCCN2C(=O)Cc2cnn(C)c2)no1 | [C][C][Branch1][C][C][C][=N][C][Branch2][Ring1][=Branch2][C][C][C][C][C][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C][C][C][=N][N][Branch1][C][C][C][=Ring1][=Branch1][=N][O][Ring2][Ring1][Branch1] | C16CCCCCN13.c14nc6no1.c15cnn(C)c1.C3(=O)C5.CC4C |
1925985 | COCc1nc(C2CCCCCN2C(=O)c2cccc(C)n2)no1 | [C][O][C][C][=N][C][Branch2][Ring1][=Branch2][C][C][C][C][C][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][C][=N][Ring1][#Branch1][=N][O][Ring2][Ring1][Branch1] | C17CCCCCN13.c15cccc(C)n1.c16nc7no1.C35=O.CO4.C46 |
1925986 | COCc1nc(C2CCCCCN2C(=O)c2cccc(OC)n2)no1 | [C][O][C][C][=N][C][Branch2][Ring1][#Branch2][C][C][C][C][C][C][N][Ring1][#Branch1][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][Ring1][O][C][=N][Ring1][Branch2][=N][O][Ring2][Ring1][=Branch1] | C18CCCCCN13.c16cccc5n1.c17nc8no1.C36=O.CO4.C47.O5C |
1925987 | COCc1nc(CSc2cc(Br)ccc2OC)no1 | [C][O][C][C][=N][C][Branch1][S][C][S][C][=C][C][Branch1][C][Br][=C][C][=C][Ring1][#Branch1][O][C][=N][O][Ring1][S] | c18cc(Br)ccc14.c16nc7no1.CO3.C36.C57.S58.O4C |
1925988 | O=c1c2ccsc2ccn1Cc1csc(C2CC2)n1 | [O][=C][C][C][=C][S][C][=Ring1][Branch1][C][=C][N][Ring1][=Branch2][C][C][=C][S][C][Branch1][=Branch1][C][C][C][Ring1][Ring1][=N][Ring1][Branch2] | O=c1c2ccsc2ccn13.c14csc5n1.C15CC1.C34 |
1925989 | COc1cc(Br)c(F)cc1S(=O)(=O)N1CCCC1 | [C][O][C][=C][C][Branch1][C][Br][=C][Branch1][C][F][C][=C][Ring1][Branch2][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][C][C][Ring1][Branch1] | c12cc(Br)c(F)cc1S3(=O)=O.N13CCCC1.CO2 |
1925990 | COc1cccc(N(C)S(=O)(=O)Cc2ccc(F)cc2F)n1 | [C][O][C][=C][C][=C][C][Branch2][Ring1][=Branch2][N][Branch1][C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][F][=N][Ring2][Ring1][Ring2] | c16ccc(F)cc1F.c13cccc5n1.S4(=O)(=O)C6.N45C.CO3 |
1925991 | CC(C)N(Cc1cccnc1)S(=O)(=O)Cc1ccc(F)cc1F | [C][C][Branch1][C][C][N][Branch1][#Branch2][C][C][=C][C][=C][N][=C][Ring1][=Branch1][S][=Branch1][C][=O][=Branch1][C][=O][C][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1][F] | c16ccc(F)cc1F.c15cccnc1.S4(=O)(=O)C6.CC2C.N234.C35 |
1925992 | CN(Cc1cnc(N(C)C)nc1)C(=O)NCc1ccc2c(c1)CCC2 | [C][N][Branch1][P][C][C][=C][N][=C][Branch1][=Branch1][N][Branch1][C][C][C][N][=C][Ring1][=Branch2][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][=Branch1][Ring2][=C][Ring1][=Branch1][C][C][C][Ring1][=Branch1] | c19ccc2c(c1)CCC2.c18cnc7nc1.CN35.N7(C)C.C34=O.C58.N46.C69 |
1925994 | CC(C)N(CC1CCCCO1)C(=O)c1ccc(-c2ncn(C)n2)cc1 | [C][C][Branch1][C][C][N][Branch1][#Branch2][C][C][C][C][C][C][O][Ring1][=Branch1][C][=Branch1][C][=O][C][=C][C][=C][Branch1][O][C][N][=C][N][Branch1][C][C][N][=Ring1][=Branch1][C][=C][Ring1][N] | c16ccc8cc1.C17CCCCO1.c18ncn(C)n1.CC4C.N345.C36=O.C57 |
1925995 | Cc1cnc(NC(=O)Cc2csc(C)n2)c(C)c1 | [C][C][=C][N][=C][Branch1][P][N][C][=Branch1][C][=O][C][C][=C][S][C][Branch1][C][C][=N][Ring1][=Branch1][C][Branch1][C][C][=C][Ring1][P] | Cc1cnc4c(C)c1.c15csc(C)n1.C3(=O)C5.N34 |
1925996 | CCOC1CCN(Cc2nnc(C(=O)Nc3ccccc3)s2)CC1 | [C][C][O][C][C][C][N][Branch2][Ring1][Branch2][C][C][=N][N][=C][Branch1][=C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][S][Ring1][=C][C][C][Ring2][Ring1][Branch1] | C16CCN7CC1.c1%10nnc9s1.c18ccccc1.C49=O.CC5.O56.C7%10.N48 |
1925997 | Cc1nnc(-c2ccccc2C(=O)OCc2ccc3nn[nH]c3c2)o1 | [C][C][=N][N][=C][Branch2][Ring1][N][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][O][C][C][=C][C][=C][N][=N][NH1][C][Ring1][Branch1][=C][Ring1][=Branch2][O][Ring2][Ring1][Branch2] | c17ccc2nn[nH]c2c1.c18ccccc16.Cc1nnc8o1.C46=O.O45.C57 |
1925998 | CC(C)n1cc2c(n1)C(NS(=O)(=O)N1CCOCC1)CCC2 | [C][C][Branch1][C][C][N][C][=C][C][=Branch1][Ring2][=N][Ring1][Branch1][C][Branch1][P][N][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][O][C][C][Ring1][=Branch1][C][C][C][Ring1][P] | n13cc2c(n1)C(NS(=O)(=O)N1CCOCC1)CCC2.CC3C |
1925999 | COCCn1cc2c(n1)C(NS(=O)(=O)N1CCOCC1)CCC2 | [C][O][C][C][N][C][=C][C][=Branch1][Ring2][=N][Ring1][Branch1][C][Branch1][P][N][S][=Branch1][C][=O][=Branch1][C][=O][N][C][C][O][C][C][Ring1][=Branch1][C][C][C][Ring1][P] | n14cc2c(n1)C(NS(=O)(=O)N1CCOCC1)CCC2.C3C4.CO3 |
1926000 | O=S(=O)(NC1CCCc2cn(C3CCCC3)nc21)C1CC1 | [O][=S][=Branch1][C][=O][Branch2][Ring1][Branch2][N][C][C][C][C][C][=C][N][Branch1][Branch2][C][C][C][C][C][Ring1][Branch1][N][=C][Ring1][#Branch2][Ring1][=C][C][C][C][Ring1][Ring1] | N4C1CCCc2cn5nc21.O=S4(=O)C1CC1.C15CCCC1 |
1926001 | CCOCC(=O)NC1CCCc2cn(C(C)C)nc21 | [C][C][O][C][C][=Branch1][C][=O][N][C][C][C][C][C][=C][N][Branch1][=Branch1][C][Branch1][C][C][C][N][=C][Ring1][Branch2][Ring1][N] | N3C1CCCc2cn6nc21.C5C3=O.C6(C)C.CC4.O45 |
1926002 | CC(C)c1noc(CCC(=O)NC2CCCc3cn(C(C)C)nc32)n1 | [C][C][Branch1][C][C][C][=N][O][C][Branch2][Ring1][N][C][C][C][=Branch1][C][=O][N][C][C][C][C][C][=C][N][Branch1][=Branch1][C][Branch1][C][C][C][N][=C][Ring1][Branch2][Ring1][N][=N][Ring2][Ring1][=Branch1] | N4C1CCCc2cn5nc21.c16noc7n1.C7CC4=O.CC6C.C5(C)C |
1926003 | COC(C)(C)C(=O)NC1CCCc2cn(C(C)C)nc21 | [C][O][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][N][C][C][C][C][C][=C][N][Branch1][=Branch1][C][Branch1][C][C][C][N][=C][Ring1][Branch2][Ring1][N] | N3C1CCCc2cn5nc21.C4(C)(C)C3=O.C5(C)C.CO4 |
1926004 | CC(C)n1cc2c(n1)C(NC(=O)CC(F)(F)F)CCC2 | [C][C][Branch1][C][C][N][C][=C][C][=Branch1][Ring2][=N][Ring1][Branch1][C][Branch1][#C][N][C][=Branch1][C][=O][C][C][Branch1][C][F][Branch1][C][F][F][C][C][C][Ring1][#C] | n14cc2c(n1)C(N3)CCC2.C3(=O)CC(F)(F)F.CC4C |
1926005 | COCc1cc(C(=O)NC2CCCc3cn(C(C)C)nc32)no1 | [C][O][C][C][=C][C][Branch2][Ring1][#Branch2][C][=Branch1][C][=O][N][C][C][C][C][C][=C][N][Branch1][=Branch1][C][Branch1][C][C][C][N][=C][Ring1][Branch2][Ring1][N][=N][O][Ring2][Ring1][Ring2] | N4C1CCCc2cn7nc21.c18cc6no1.C46=O.C7(C)C.CO5.C58 |
1926006 | CC(C)n1cc2c(n1)C(NC(=O)C1CCC1)CCC2 | [C][C][Branch1][C][C][N][C][=C][C][=Branch1][Ring2][=N][Ring1][Branch1][C][Branch1][N][N][C][=Branch1][C][=O][C][C][C][C][Ring1][Ring2][C][C][C][Ring1][=C] | n15cc2c(n1)C(N3)CCC2.C14CCC1.CC5C.C34=O |
1926007 | CC(C)CC1(C(=O)NC2CCCc3cn(CC(N)=O)nc32)CCC1 | [C][C][Branch1][C][C][C][C][Branch2][Ring1][O][C][=Branch1][C][=O][N][C][C][C][C][C][=C][N][Branch1][#Branch1][C][C][Branch1][C][N][=O][N][=C][Ring1][=Branch2][Ring1][=N][C][C][C][Ring2][Ring1][Ring2] | N4C1CCCc2cn6nc21.C157CCC1.CC(C)C7.C6C(N)=O.C45=O |
1926008 | COCCn1cc2c(n1)C(NC(=O)CCC(C)C)CCC2 | [C][O][C][C][N][C][=C][C][=Branch1][Ring2][=N][Ring1][Branch1][C][Branch1][=N][N][C][=Branch1][C][=O][C][C][C][Branch1][C][C][C][C][C][C][Ring1][#C] | n15cc2c(n1)C(N3)CCC2.C3(=O)CCC(C)C.C4C5.CO4 |
1926009 | CC(C)CCC(=O)NC1CCCc2cn(CC(=O)N(C)C)nc21 | [C][C][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C][C][C][C][C][=C][N][Branch1][O][C][C][=Branch1][C][=O][N][Branch1][C][C][C][N][=C][Ring1][O][Ring1][#C] | N3C1CCCc2cn5nc21.CC(C)CCC3=O.C5C4=O.N4(C)C |
1926010 | CCC(CC)C(=O)NC1CCCc2cn(CC(=O)N(C)C)nc21 | [C][C][C][Branch1][Ring1][C][C][C][=Branch1][C][=O][N][C][C][C][C][C][=C][N][Branch1][O][C][C][=Branch1][C][=O][N][Branch1][C][C][C][N][=C][Ring1][O][Ring1][#C] | N3C1CCCc2cn5nc21.CCC(CC)C3=O.C5C4=O.N4(C)C |
1926011 | CC(C)CCC(=O)NC1CCCc2cn(CC(F)(F)F)nc21 | [C][C][Branch1][C][C][C][C][C][=Branch1][C][=O][N][C][C][C][C][C][=C][N][Branch1][#Branch2][C][C][Branch1][C][F][Branch1][C][F][F][N][=C][Ring1][#Branch2][Ring1][=C] | N3C1CCCc2cn4nc21.CC(C)CCC3=O.C4C(F)(F)F |
1926012 | O=C(NC1CCCc2cn(CC(F)(F)F)nc21)C1CCC1 | [O][=C][Branch2][Ring1][#Branch2][N][C][C][C][C][C][=C][N][Branch1][#Branch2][C][C][Branch1][C][F][Branch1][C][F][F][N][=C][Ring1][#Branch2][Ring1][=C][C][C][C][C][Ring1][Ring2] | N3C1CCCc2cn5nc21.C5C(F)(F)F.C14CCC1.O=C34 |
1926013 | COc1ccc(C(=O)NC2CCCc3cn(C4CCCC4)nc32)nn1 | [C][O][C][=C][C][=C][Branch2][Ring1][N][C][=Branch1][C][=O][N][C][C][C][C][C][=C][N][Branch1][Branch2][C][C][C][C][C][Ring1][Branch1][N][=C][Ring1][#Branch2][Ring1][=C][N][=N][Ring2][Ring1][#Branch1] | N5C1CCCc2cn8nc21.c16ccc7nn1.C18CCCC1.C57=O.CO6 |
1926014 | Cc1nccc(CNC(=O)Nc2ccc(Cl)c(OC(F)F)c2)n1 | [C][C][=N][C][=C][C][Branch2][Ring1][O][C][N][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][Cl][C][Branch1][#Branch1][O][C][Branch1][C][F][F][=C][Ring1][O][=N][Ring2][Ring1][=Branch1] | c17ccc(Cl)c5c1.Cc1nccc8n1.O5C(F)F.C34=O.C68.N36.N47 |
1926015 | Cc1ccc(CC(=O)N(C)C(CCO)c2ccccc2)cc1O | [C][C][=C][C][=C][Branch2][Ring1][Branch2][C][C][=Branch1][C][=O][N][Branch1][C][C][C][Branch1][Ring2][C][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C][Ring2][Ring1][Branch1][O] | Cc1ccc5cc1O.c16ccccc1.C46CCO.C5C3=O.N34C |
1926016 | O=C(NCC1CCCO1)Nc1ccc(Cl)c(OC(F)F)c1 | [O][=C][Branch1][#Branch2][N][C][C][C][C][C][O][Ring1][Branch1][N][C][=C][C][=C][Branch1][C][Cl][C][Branch1][#Branch1][O][C][Branch1][C][F][F][=C][Ring1][O] | c16ccc(Cl)c4c1.C17CCCO1.O4C(F)F.O=C23.N25.C57.N36 |
1926018 | Cn1cc(NC(=O)Nc2ccc(Cl)c(OC(F)F)c2)cn1 | [C][N][C][=C][Branch2][Ring1][#Branch2][N][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][Cl][C][Branch1][#Branch1][O][C][Branch1][C][F][F][=C][Ring1][O][C][=N][Ring2][Ring1][Ring2] | c17ccc(Cl)c5c1.Cn1cc6cn1.O5C(F)F.C34=O.N36.N47 |
1926019 | CC(Cc1ccccc1C(F)(F)F)NC(=O)Cc1ccn[nH]1 | [C][C][Branch2][Ring1][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][F][Branch1][C][F][F][N][C][=Branch1][C][=O][C][C][=C][C][=N][NH1][Ring1][Branch1] | c15ccccc16.c14ccn[nH]1.CC3C5.C6(F)(F)F.C2(=O)C4.N23 |
1926020 | CN(CCN1CCCC1=O)C(=O)NCc1ccc2ccccc2c1 | [C][N][Branch1][O][C][C][N][C][C][C][C][Ring1][Branch1][=O][C][=Branch1][C][=O][N][C][C][=C][C][=C][C][=C][C][=C][C][Ring1][=Branch1][=C][Ring1][#Branch2] | c18ccc2ccccc2c1.N17CCCC1=O.CN35.C5C7.C34=O.N46.C68 |
1926021 | CC1CN(CCCNC(=O)c2cccc(O)c2)CC(C)O1 | [C][C][C][N][Branch2][Ring1][Ring2][C][C][C][N][C][=Branch1][C][=O][C][=C][C][=C][C][Branch1][C][O][=C][Ring1][#Branch1][C][C][Branch1][C][C][O][Ring2][Ring1][Ring2] | CC1CN4CC(C)O1.c16cccc(O)c1.C4CC5.C36=O.N35 |
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