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

Systemtic Name: N-(2-azanylcyclohexyl)-1-(4-chlorophenyl)carbonyl-2-cyclohexyl-4-oxidanylidene-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Openeye Name: N-(2-aminocyclohexyl)-1-(4-chlorobenzoyl)-2-cyclohexyl-4-oxo-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide CAS Name: N-(2-aminocyclohexyl)-1-[(4-chlorophenyl)-oxomethyl]-2-cyclohexyl-4-oxo-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide IUPAC Name: N-(2-aminocyclohexyl)-1-(4-chlorobenzoyl)-2-cyclohexyl-4-oxo-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Traditional Name: N-(2-aminocyclohexyl)-1-(4-chlorobenzoyl)-2-cyclohexyl-4-keto-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Formula: C29H35ClN4O3 MolecularWeight: 523.0662

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2CC(=O)NC3=C(N2C(=O)C4=CC=C(C=C4)Cl)C=CC(=C3)C(=O)NC5CCCCC5N

Isomeric SMILES

C1CCC(CC1)C2CC(=O)NC3=C(N2C(=O)C4=CC=C(C=C4)Cl)C=CC(=C3)C(=O)NC5CCCCC5N

InChI

InChI=1S/C29H35ClN4O3/c30-21-13-10-19(11-14-21)29(37)34-25-15-12-20(28(36)33-23-9-5-4-8-22(23)31)16-24(25)32-27(35)17-26(34)18-6-2-1-3-7-18/h10-16,18,22-23,26H,1-9,17,31H2,(H,32,35)(H,33,36)