1-(1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)-3-[[3-(2-oxidanylpropan-2-yl)phenyl]methyl]urea

Systemtic Name: 1-(1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)-3-[[3-(2-oxidanylpropan-2-yl)phenyl]methyl]urea Openeye Name: 1-[[3-(1-hydroxy-1-methyl-ethyl)phenyl]methyl]-3-(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)urea CAS Name: 1-[[3-(2-hydroxypropan-2-yl)phenyl]methyl]-3-(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)urea IUPAC Name: 1-[[3-(2-hydroxypropan-2-yl)phenyl]methyl]-3-(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)urea Traditional Name: 1-[3-(1-hydroxy-1-methyl-ethyl)benzyl]-3-(2-keto-1-methyl-5-phenyl-3H-1,4-benzodiazepin-3-yl)urea Formula: C27H28N4O3 MolecularWeight: 456.53622

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC(=C1)CNC(=O)NC2C(=O)N(C3=CC=CC=C3C(=N2)C4=CC=CC=C4)C)O

Isomeric SMILES

CC(C)(C1=CC=CC(=C1)CNC(=O)NC2C(=O)N(C3=CC=CC=C3C(=N2)C4=CC=CC=C4)C)O

InChI

InChI=1S/C27H28N4O3/c1-27(2,34)20-13-9-10-18(16-20)17-28-26(33)30-24-25(32)31(3)22-15-8-7-14-21(22)23(29-24)19-11-5-4-6-12-19/h4-16,24,34H,17H2,1-3H3,(H2,28,30,33)