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

Systemtic Name: 1-[3-(hydroxymethyl)phenyl]-3-[(3R)-1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl]urea Openeye Name: 1-[3-(hydroxymethyl)phenyl]-3-[(3R)-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]urea CAS Name: 1-[3-(hydroxymethyl)phenyl]-3-[(3R)-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]urea IUPAC Name: 1-[3-(hydroxymethyl)phenyl]-3-[(3R)-1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl]urea Traditional Name: 1-[(3R)-2-keto-1-methyl-5-phenyl-3H-1,4-benzodiazepin-3-yl]-3-(3-methylolphenyl)urea Formula: C24H22N4O3 MolecularWeight: 414.45648

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)NC3=CC=CC(=C3)CO)C4=CC=CC=C4

Isomeric SMILES

CN1C2=CC=CC=C2C(=N[C@H](C1=O)NC(=O)NC3=CC=CC(=C3)CO)C4=CC=CC=C4

InChI

InChI=1S/C24H22N4O3/c1-28-20-13-6-5-12-19(20)21(17-9-3-2-4-10-17)26-22(23(28)30)27-24(31)25-18-11-7-8-16(14-18)15-29/h2-14,22,29H,15H2,1H3,(H2,25,27,31)/t22-/m0/s1