N-(2-azanylcyclohexyl)-1-(4-methylphenyl)carbonyl-4-oxidanylidene-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide

Systemtic Name: N-(2-azanylcyclohexyl)-1-(4-methylphenyl)carbonyl-4-oxidanylidene-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Openeye Name: N-(2-aminocyclohexyl)-1-(4-methylbenzoyl)-4-oxo-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide CAS Name: N-(2-aminocyclohexyl)-1-[(4-methylphenyl)-oxomethyl]-4-oxo-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide IUPAC Name: N-(2-aminocyclohexyl)-1-(4-methylbenzoyl)-4-oxo-2-phenyl-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Traditional Name: N-(2-aminocyclohexyl)-4-keto-2-phenyl-1-p-toluoyl-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Formula: C30H32N4O3 MolecularWeight: 496.60008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2C(CC(=O)NC3=C2C=CC(=C3)C(=O)NC4CCCCC4N)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2C(CC(=O)NC3=C2C=CC(=C3)C(=O)NC4CCCCC4N)C5=CC=CC=C5

InChI

InChI=1S/C30H32N4O3/c1-19-11-13-21(14-12-19)30(37)34-26-16-15-22(29(36)33-24-10-6-5-9-23(24)31)17-25(26)32-28(35)18-27(34)20-7-3-2-4-8-20/h2-4,7-8,11-17,23-24,27H,5-6,9-10,18,31H2,1H3,(H,32,35)(H,33,36)