4-[(4-chlorophenyl)methyl]-N-cyclohexyl-5-oxidanylidene-2-phenyl-3H-1,4-benzodiazepine-3-carboxamide

Systemtic Name: 4-[(4-chlorophenyl)methyl]-N-cyclohexyl-5-oxidanylidene-2-phenyl-3H-1,4-benzodiazepine-3-carboxamide Openeye Name: 4-[(4-chlorophenyl)methyl]-N-cyclohexyl-5-oxo-2-phenyl-3H-1,4-benzodiazepine-3-carboxamide CAS Name: 4-[(4-chlorophenyl)methyl]-N-cyclohexyl-5-oxo-2-phenyl-3H-1,4-benzodiazepine-3-carboxamide IUPAC Name: 4-[(4-chlorophenyl)methyl]-N-cyclohexyl-5-oxo-2-phenyl-3H-1,4-benzodiazepine-3-carboxamide Traditional Name: 4-(4-chlorobenzyl)-N-cyclohexyl-5-keto-2-phenyl-3H-1,4-benzodiazepine-3-carboxamide Formula: C29H28ClN3O2 MolecularWeight: 486.00452

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C2C(=NC3=CC=CC=C3C(=O)N2CC4=CC=C(C=C4)Cl)C5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)NC(=O)C2C(=NC3=CC=CC=C3C(=O)N2CC4=CC=C(C=C4)Cl)C5=CC=CC=C5

InChI

InChI=1S/C29H28ClN3O2/c30-22-17-15-20(16-18-22)19-33-27(28(34)31-23-11-5-2-6-12-23)26(21-9-3-1-4-10-21)32-25-14-8-7-13-24(25)29(33)35/h1,3-4,7-10,13-18,23,27H,2,5-6,11-12,19H2,(H,31,34)