1-[1-(4-chlorophenyl)carbonyl-5-[2-(2-methylphenyl)-2-oxidanylidene-ethyl]-4-oxidanylidene-2,3-dihydro-1,5-benzodiazepin-3-yl]-3-(3-methylphenyl)urea

Systemtic Name: 1-[1-(4-chlorophenyl)carbonyl-5-[2-(2-methylphenyl)-2-oxidanylidene-ethyl]-4-oxidanylidene-2,3-dihydro-1,5-benzodiazepin-3-yl]-3-(3-methylphenyl)urea Openeye Name: 1-[1-(4-chlorobenzoyl)-5-[2-(o-tolyl)-2-oxo-ethyl]-4-oxo-2,3-dihydro-1,5-benzodiazepin-3-yl]-3-(m-tolyl)urea CAS Name: 1-[1-[(4-chlorophenyl)-oxomethyl]-5-[2-(2-methylphenyl)-2-oxoethyl]-4-oxo-2,3-dihydro-1,5-benzodiazepin-3-yl]-3-(3-methylphenyl)urea IUPAC Name: 1-[1-(4-chlorobenzoyl)-5-[2-(2-methylphenyl)-2-oxoethyl]-4-oxo-2,3-dihydro-1,5-benzodiazepin-3-yl]-3-(3-methylphenyl)urea Traditional Name: 1-[1-(4-chlorobenzoyl)-4-keto-5-[2-keto-2-(o-tolyl)ethyl]-2,3-dihydro-1,5-benzodiazepin-3-yl]-3-(m-tolyl)urea Formula: C33H29ClN4O4 MolecularWeight: 581.06076

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)NC2CN(C3=CC=CC=C3N(C2=O)CC(=O)C4=CC=CC=C4C)C(=O)C5=CC=C(C=C5)Cl

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NC2CN(C3=CC=CC=C3N(C2=O)CC(=O)C4=CC=CC=C4C)C(=O)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C33H29ClN4O4/c1-21-8-7-10-25(18-21)35-33(42)36-27-19-37(31(40)23-14-16-24(34)17-15-23)28-12-5-6-13-29(28)38(32(27)41)20-30(39)26-11-4-3-9-22(26)2/h3-18,27H,19-20H2,1-2H3,(H2,35,36,42)