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

Systemtic Name: N-(2-azanylcyclohexyl)-1-(4-tert-butylphenyl)carbonyl-2-(4-methylphenyl)-4-oxidanylidene-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Openeye Name: N-(2-aminocyclohexyl)-1-(4-tert-butylbenzoyl)-4-oxo-2-(p-tolyl)-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide CAS Name: N-(2-aminocyclohexyl)-1-[(4-tert-butylphenyl)-oxomethyl]-2-(4-methylphenyl)-4-oxo-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide IUPAC Name: N-(2-aminocyclohexyl)-1-(4-tert-butylbenzoyl)-2-(4-methylphenyl)-4-oxo-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Traditional Name: N-(2-aminocyclohexyl)-1-(4-tert-butylbenzoyl)-4-keto-2-(p-tolyl)-3,5-dihydro-2H-1,5-benzodiazepine-7-carboxamide Formula: C34H40N4O3 MolecularWeight: 552.7064

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2CC(=O)NC3=C(N2C(=O)C4=CC=C(C=C4)C(C)(C)C)C=CC(=C3)C(=O)NC5CCCCC5N

Isomeric SMILES

CC1=CC=C(C=C1)C2CC(=O)NC3=C(N2C(=O)C4=CC=C(C=C4)C(C)(C)C)C=CC(=C3)C(=O)NC5CCCCC5N

InChI

InChI=1S/C34H40N4O3/c1-21-9-11-22(12-10-21)30-20-31(39)36-28-19-24(32(40)37-27-8-6-5-7-26(27)35)15-18-29(28)38(30)33(41)23-13-16-25(17-14-23)34(2,3)4/h9-19,26-27,30H,5-8,20,35H2,1-4H3,(H,36,39)(H,37,40)