3-(cyclopropylmethyl)-N'-[1-[[3-(4-methylphenyl)phenyl]methyl]-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl]-2-propyl-butanediamide

Systemtic Name: 3-(cyclopropylmethyl)-N'-[1-[[3-(4-methylphenyl)phenyl]methyl]-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl]-2-propyl-butanediamide Openeye Name: 3-(cyclopropylmethyl)-N'-[2-oxo-5-phenyl-1-[[3-(p-tolyl)phenyl]methyl]-3H-1,4-benzodiazepin-3-yl]-2-propyl-butanediamide CAS Name: 3-(cyclopropylmethyl)-N'-[1-[[3-(4-methylphenyl)phenyl]methyl]-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]-2-propylbutanediamide IUPAC Name: 3-(cyclopropylmethyl)-N'-[1-[[3-(4-methylphenyl)phenyl]methyl]-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]-2-propylbutanediamide Traditional Name: 3-(cyclopropylmethyl)-N'-[2-keto-5-phenyl-1-[3-(p-tolyl)benzyl]-3H-1,4-benzodiazepin-3-yl]-2-propyl-succinamide Formula: C40H42N4O3 MolecularWeight: 626.78648

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(C(CC1CC1)C(=O)NC2C(=O)N(C3=CC=CC=C3C(=N2)C4=CC=CC=C4)CC5=CC=CC(=C5)C6=CC=C(C=C6)C)C(=O)N

Isomeric SMILES

CCCC(C(CC1CC1)C(=O)NC2C(=O)N(C3=CC=CC=C3C(=N2)C4=CC=CC=C4)CC5=CC=CC(=C5)C6=CC=C(C=C6)C)C(=O)N

InChI

InChI=1S/C40H42N4O3/c1-3-10-32(37(41)45)34(24-27-19-20-27)39(46)43-38-40(47)44(25-28-11-9-14-31(23-28)29-21-17-26(2)18-22-29)35-16-8-7-15-33(35)36(42-38)30-12-5-4-6-13-30/h4-9,11-18,21-23,27,32,34,38H,3,10,19-20,24-25H2,1-2H3,(H2,41,45)(H,43,46)