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

Systemtic Name: 1-[5-(2-cyclopropyl-2-oxidanylidene-ethyl)-1-(2,2-dimethylpropanoyl)-4-oxidanylidene-2,3-dihydro-1,5-benzodiazepin-3-yl]-3-(3-methylphenyl)urea Openeye Name: 1-[5-(2-cyclopropyl-2-oxo-ethyl)-1-(2,2-dimethylpropanoyl)-4-oxo-2,3-dihydro-1,5-benzodiazepin-3-yl]-3-(m-tolyl)urea CAS Name: 1-[5-(2-cyclopropyl-2-oxoethyl)-1-(2,2-dimethyl-1-oxopropyl)-4-oxo-2,3-dihydro-1,5-benzodiazepin-3-yl]-3-(3-methylphenyl)urea IUPAC Name: 1-[5-(2-cyclopropyl-2-oxoethyl)-1-(2,2-dimethylpropanoyl)-4-oxo-2,3-dihydro-1,5-benzodiazepin-3-yl]-3-(3-methylphenyl)urea Traditional Name: 1-[5-(2-cyclopropyl-2-keto-ethyl)-4-keto-1-pivaloyl-2,3-dihydro-1,5-benzodiazepin-3-yl]-3-(m-tolyl)urea Formula: C27H32N4O4 MolecularWeight: 476.56738

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)NC2CN(C3=CC=CC=C3N(C2=O)CC(=O)C4CC4)C(=O)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NC2CN(C3=CC=CC=C3N(C2=O)CC(=O)C4CC4)C(=O)C(C)(C)C

InChI

InChI=1S/C27H32N4O4/c1-17-8-7-9-19(14-17)28-26(35)29-20-15-31(25(34)27(2,3)4)22-11-6-5-10-21(22)30(24(20)33)16-23(32)18-12-13-18/h5-11,14,18,20H,12-13,15-16H2,1-4H3,(H2,28,29,35)