1-[1-(3,3-dimethyl-2-oxidanylidene-butyl)-8-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl]-3-(3-methylphenyl)urea

Systemtic Name: 1-[1-(3,3-dimethyl-2-oxidanylidene-butyl)-8-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl]-3-(3-methylphenyl)urea Openeye Name: 1-[1-(3,3-dimethyl-2-oxo-butyl)-8-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]-3-(m-tolyl)urea CAS Name: 1-[1-(3,3-dimethyl-2-oxobutyl)-8-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]-3-(3-methylphenyl)urea IUPAC Name: 1-[1-(3,3-dimethyl-2-oxobutyl)-8-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]-3-(3-methylphenyl)urea Traditional Name: 1-[2-keto-1-(2-keto-3,3-dimethyl-butyl)-8-methyl-5-phenyl-3H-1,4-benzodiazepin-3-yl]-3-(m-tolyl)urea Formula: C30H32N4O3 MolecularWeight: 496.60008

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)NC2C(=O)N(C3=C(C=CC(=C3)C)C(=N2)C4=CC=CC=C4)CC(=O)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NC2C(=O)N(C3=C(C=CC(=C3)C)C(=N2)C4=CC=CC=C4)CC(=O)C(C)(C)C

InChI

InChI=1S/C30H32N4O3/c1-19-10-9-13-22(16-19)31-29(37)33-27-28(36)34(18-25(35)30(3,4)5)24-17-20(2)14-15-23(24)26(32-27)21-11-7-6-8-12-21/h6-17,27H,18H2,1-5H3,(H2,31,33,37)