1-[5-(3,3-dimethyl-2-oxidanylidene-butyl)-4-oxidanylidene-1-phenyl-2,3-dihydro-1,5-benzodiazepin-3-yl]-3-(3-methylphenyl)urea

Systemtic Name: 1-[5-(3,3-dimethyl-2-oxidanylidene-butyl)-4-oxidanylidene-1-phenyl-2,3-dihydro-1,5-benzodiazepin-3-yl]-3-(3-methylphenyl)urea Openeye Name: 1-[5-(3,3-dimethyl-2-oxo-butyl)-4-oxo-1-phenyl-2,3-dihydro-1,5-benzodiazepin-3-yl]-3-(m-tolyl)urea CAS Name: 1-[5-(3,3-dimethyl-2-oxobutyl)-4-oxo-1-phenyl-2,3-dihydro-1,5-benzodiazepin-3-yl]-3-(3-methylphenyl)urea IUPAC Name: 1-[5-(3,3-dimethyl-2-oxobutyl)-4-oxo-1-phenyl-2,3-dihydro-1,5-benzodiazepin-3-yl]-3-(3-methylphenyl)urea Traditional Name: 1-[4-keto-5-(2-keto-3,3-dimethyl-butyl)-1-phenyl-2,3-dihydro-1,5-benzodiazepin-3-yl]-3-(m-tolyl)urea Formula: C29H32N4O3 MolecularWeight: 484.58938

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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)C(C)(C)C)C4=CC=CC=C4

Isomeric SMILES

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

InChI

InChI=1S/C29H32N4O3/c1-20-11-10-12-21(17-20)30-28(36)31-23-18-32(22-13-6-5-7-14-22)24-15-8-9-16-25(24)33(27(23)35)19-26(34)29(2,3)4/h5-17,23H,18-19H2,1-4H3,(H2,30,31,36)