1-(5-cyclohexyl-1,9-dimethyl-2-oxidanylidene-3H-1,4-benzodiazepin-3-yl)-3-(3-methylphenyl)urea

Systemtic Name: 1-(5-cyclohexyl-1,9-dimethyl-2-oxidanylidene-3H-1,4-benzodiazepin-3-yl)-3-(3-methylphenyl)urea Openeye Name: 1-(5-cyclohexyl-1,9-dimethyl-2-oxo-3H-1,4-benzodiazepin-3-yl)-3-(m-tolyl)urea CAS Name: 1-(5-cyclohexyl-1,9-dimethyl-2-oxo-3H-1,4-benzodiazepin-3-yl)-3-(3-methylphenyl)urea IUPAC Name: 1-(5-cyclohexyl-1,9-dimethyl-2-oxo-3H-1,4-benzodiazepin-3-yl)-3-(3-methylphenyl)urea Traditional Name: 1-(5-cyclohexyl-2-keto-1,9-dimethyl-3H-1,4-benzodiazepin-3-yl)-3-(m-tolyl)urea Formula: C25H30N4O2 MolecularWeight: 418.5313

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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)C

Isomeric SMILES

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

InChI

InChI=1S/C25H30N4O2/c1-16-9-7-13-19(15-16)26-25(31)28-23-24(30)29(3)22-17(2)10-8-14-20(22)21(27-23)18-11-5-4-6-12-18/h7-10,13-15,18,23H,4-6,11-12H2,1-3H3,(H2,26,28,31)