1-(3-methylphenyl)-3-[1-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl]urea

Systemtic Name: 1-(3-methylphenyl)-3-[1-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl]urea Openeye Name: 1-(m-tolyl)-3-[2-oxo-1-[2-oxo-2-(p-tolyl)ethyl]-5-phenyl-3H-1,4-benzodiazepin-3-yl]urea CAS Name: 1-(3-methylphenyl)-3-[1-[2-(4-methylphenyl)-2-oxoethyl]-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]urea IUPAC Name: 1-(3-methylphenyl)-3-[1-[2-(4-methylphenyl)-2-oxoethyl]-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]urea Traditional Name: 1-[2-keto-1-[2-keto-2-(p-tolyl)ethyl]-5-phenyl-3H-1,4-benzodiazepin-3-yl]-3-(m-tolyl)urea Formula: C32H28N4O3 MolecularWeight: 516.58972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CN2C3=CC=CC=C3C(=NC(C2=O)NC(=O)NC4=CC=CC(=C4)C)C5=CC=CC=C5

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CN2C3=CC=CC=C3C(=NC(C2=O)NC(=O)NC4=CC=CC(=C4)C)C5=CC=CC=C5

InChI

InChI=1S/C32H28N4O3/c1-21-15-17-23(18-16-21)28(37)20-36-27-14-7-6-13-26(27)29(24-10-4-3-5-11-24)34-30(31(36)38)35-32(39)33-25-12-8-9-22(2)19-25/h3-19,30H,20H2,1-2H3,(H2,33,35,39)