1-[1-[2-(2-methylphenyl)-2-oxidanylidene-ethyl]-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl]-3-propan-2-yl-urea

Systemtic Name: 1-[1-[2-(2-methylphenyl)-2-oxidanylidene-ethyl]-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl]-3-propan-2-yl-urea Openeye Name: 1-isopropyl-3-[1-[2-(o-tolyl)-2-oxo-ethyl]-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]urea CAS Name: 1-[1-[2-(2-methylphenyl)-2-oxoethyl]-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]-3-propan-2-ylurea IUPAC Name: 1-[1-[2-(2-methylphenyl)-2-oxoethyl]-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]-3-propan-2-ylurea Traditional Name: 1-isopropyl-3-[2-keto-1-[2-keto-2-(o-tolyl)ethyl]-5-phenyl-3H-1,4-benzodiazepin-3-yl]urea Formula: C28H28N4O3 MolecularWeight: 468.54692

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)CN2C3=CC=CC=C3C(=NC(C2=O)NC(=O)NC(C)C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=CC=C1C(=O)CN2C3=CC=CC=C3C(=NC(C2=O)NC(=O)NC(C)C)C4=CC=CC=C4

InChI

InChI=1S/C28H28N4O3/c1-18(2)29-28(35)31-26-27(34)32(17-24(33)21-14-8-7-11-19(21)3)23-16-10-9-15-22(23)25(30-26)20-12-5-4-6-13-20/h4-16,18,26H,17H2,1-3H3,(H2,29,31,35)