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

Systemtic Name: 1-[5-(3-methylbutyl)-2-oxidanylidene-3,4-dihydro-1,4-benzodiazepin-3-yl]-3-(3-methylphenyl)urea Openeye Name: 1-(5-isopentyl-2-oxo-3,4-dihydro-1,4-benzodiazepin-3-yl)-3-(m-tolyl)urea CAS Name: 1-[5-(3-methylbutyl)-2-oxo-3,4-dihydro-1,4-benzodiazepin-3-yl]-3-(3-methylphenyl)urea IUPAC Name: 1-[5-(3-methylbutyl)-2-oxo-3,4-dihydro-1,4-benzodiazepin-3-yl]-3-(3-methylphenyl)urea Traditional Name: 1-(5-isoamyl-2-keto-3,4-dihydro-1,4-benzodiazepin-3-yl)-3-(m-tolyl)urea Formula: C22H26N4O2 MolecularWeight: 378.46744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)NC2C(=O)N=C3C=CC=CC3=C(N2)CCC(C)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NC2C(=O)N=C3C=CC=CC3=C(N2)CCC(C)C

InChI

InChI=1S/C22H26N4O2/c1-14(2)11-12-19-17-9-4-5-10-18(17)25-21(27)20(24-19)26-22(28)23-16-8-6-7-15(3)13-16/h4-10,13-14,20,24H,11-12H2,1-3H3,(H2,23,26,28)