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

Systemtic Name: 1-[5,9-dimethyl-2-oxidanylidene-1-(2-oxidanylidene-2-piperidin-1-yl-ethyl)-3H-1,4-benzodiazepin-3-yl]-3-(3-methylphenyl)urea Openeye Name: 1-[5,9-dimethyl-2-oxo-1-[2-oxo-2-(1-piperidyl)ethyl]-3H-1,4-benzodiazepin-3-yl]-3-(m-tolyl)urea CAS Name: 1-[5,9-dimethyl-2-oxo-1-[2-oxo-2-(1-piperidinyl)ethyl]-3H-1,4-benzodiazepin-3-yl]-3-(3-methylphenyl)urea IUPAC Name: 1-[5,9-dimethyl-2-oxo-1-(2-oxo-2-piperidin-1-ylethyl)-3H-1,4-benzodiazepin-3-yl]-3-(3-methylphenyl)urea Traditional Name: 1-[2-keto-1-(2-keto-2-piperidino-ethyl)-5,9-dimethyl-3H-1,4-benzodiazepin-3-yl]-3-(m-tolyl)urea Formula: C26H31N5O3 MolecularWeight: 461.55604

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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)C)CC(=O)N4CCCCC4

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NC2C(=O)N(C3=C(C=CC=C3C)C(=N2)C)CC(=O)N4CCCCC4

InChI

InChI=1S/C26H31N5O3/c1-17-9-7-11-20(15-17)28-26(34)29-24-25(33)31(16-22(32)30-13-5-4-6-14-30)23-18(2)10-8-12-21(23)19(3)27-24/h7-12,15,24H,4-6,13-14,16H2,1-3H3,(H2,28,29,34)