(1S,3aS,3bS,5aR,9aR,9bS,11aS)-N-tert-butyl-9a,11a-dimethyl-7-oxidanylidene-1,2,3,3a,3b,4,5,5a,6,9b,10,11-dodecahydroindeno[5,4-f]quinoline-1-carboxamide; [4-(4-azanyl-6,7-dimethoxy-1,2,3,4-tetrahydroquinazolin-2-yl)piperazin-1-yl]-(oxolan-2-yl)methanone

Systemtic Name: (1S,3aS,3bS,5aR,9aR,9bS,11aS)-N-tert-butyl-9a,11a-dimethyl-7-oxidanylidene-1,2,3,3a,3b,4,5,5a,6,9b,10,11-dodecahydroindeno[5,4-f]quinoline-1-carboxamide; [4-(4-azanyl-6,7-dimethoxy-1,2,3,4-tetrahydroquinazolin-2-yl)piperazin-1-yl]-(oxolan-2-yl)methanone Openeye Name: (1S,3aS,3bS,5aR,9aR,9bS,11aS)-N-tert-butyl-9a,11a-dimethyl-7-oxo-1,2,3,3a,3b,4,5,5a,6,9b,10,11-dodecahydroindeno[5,4-f]quinoline-1-carboxamide; [4-(4-amino-6,7-dimethoxy-1,2,3,4-tetrahydroquinazolin-2-yl)piperazin-1-yl]-tetrahydrofuran-2-yl-methanone CAS Name: (1S,3aS,3bS,5aR,9aR,9bS,11aS)-N-tert-butyl-9a,11a-dimethyl-7-oxo-1,2,3,3a,3b,4,5,5a,6,9b,10,11-dodecahydroindeno[5,4-f]quinoline-1-carboxamide; [4-(4-amino-6,7-dimethoxy-1,2,3,4-tetrahydroquinazolin-2-yl)-1-piperazinyl]-(2-oxolanyl)methanone IUPAC Name: (1S,3aS,3bS,5aR,9aR,9bS,11aS)-N-tert-butyl-9a,11a-dimethyl-7-oxo-1,2,3,3a,3b,4,5,5a,6,9b,10,11-dodecahydroindeno[5,4-f]quinoline-1-carboxamide; [4-(4-amino-6,7-dimethoxy-1,2,3,4-tetrahydroquinazolin-2-yl)piperazin-1-yl]-(oxolan-2-yl)methanone Traditional Name: (1S,3aS,3bS,5aR,9aR,9bS,11aS)-N-tert-butyl-7-keto-9a,11a-dimethyl-1,2,3,3a,3b,4,5,5a,6,9b,10,11-dodecahydroindeno[5,4-f]quinoline-1-carboxamide; [4-(4-amino-6,7-dimethoxy-1,2,3,4-tetrahydroquinazolin-2-yl)piperazino]-(tetrahydrofuryl)methanone Formula: C42H65N7O6 MolecularWeight: 764.0088

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCC3C(C1CCC2C(=O)NC(C)(C)C)CCC4C3(C=CC(=O)N4)C.COC1=C(C=C2C(=C1)C(NC(N2)N3CCN(CC3)C(=O)C4CCCO4)N)OC

Isomeric SMILES

C[C@]12CC[C@H]3[C@H]([C@@H]1CC[C@@H]2C(=O)NC(C)(C)C)CC[C@@H]4[C@@]3(C=CC(=O)N4)C.COC1=C(C=C2C(=C1)C(NC(N2)N3CCN(CC3)C(=O)C4CCCO4)N)OC

InChI

InChI=1S/C23H36N2O2.C19H29N5O4/c1-21(2,3)25-20(27)17-8-7-15-14-6-9-18-23(5,13-11-19(26)24-18)16(14)10-12-22(15,17)4;1-26-15-10-12-13(11-16(15)27-2)21-19(22-17(12)20)24-7-5-23(6-8-24)18(25)14-4-3-9-28-14/h11,13-18H,6-10,12H2,1-5H3,(H,24,26)(H,25,27);10-11,14,17,19,21-22H,3-9,20H2,1-2H3/t14-,15-,16-,17+,18+,22-,23+;/m0./s1