1-[5-cyclohexyl-1-(2-cyclohexyl-2-oxidanylidene-ethyl)-9-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-3-yl]-3-(3-methylphenyl)urea

Systemtic Name: 1-[5-cyclohexyl-1-(2-cyclohexyl-2-oxidanylidene-ethyl)-9-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-3-yl]-3-(3-methylphenyl)urea Openeye Name: 1-[5-cyclohexyl-1-(2-cyclohexyl-2-oxo-ethyl)-9-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl]-3-(m-tolyl)urea CAS Name: 1-[5-cyclohexyl-1-(2-cyclohexyl-2-oxoethyl)-9-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl]-3-(3-methylphenyl)urea IUPAC Name: 1-[5-cyclohexyl-1-(2-cyclohexyl-2-oxoethyl)-9-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl]-3-(3-methylphenyl)urea Traditional Name: 1-[5-cyclohexyl-1-(2-cyclohexyl-2-keto-ethyl)-2-keto-9-methyl-3H-1,4-benzodiazepin-3-yl]-3-(m-tolyl)urea Formula: C32H40N4O3 MolecularWeight: 528.685

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)NC2C(=O)N(C3=C(C=CC=C3C)C(=N2)C4CCCCC4)CC(=O)C5CCCCC5

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NC2C(=O)N(C3=C(C=CC=C3C)C(=N2)C4CCCCC4)CC(=O)C5CCCCC5

InChI

InChI=1S/C32H40N4O3/c1-21-11-9-17-25(19-21)33-32(39)35-30-31(38)36(20-27(37)23-13-5-3-6-14-23)29-22(2)12-10-18-26(29)28(34-30)24-15-7-4-8-16-24/h9-12,17-19,23-24,30H,3-8,13-16,20H2,1-2H3,(H2,33,35,39)