1-(3-methylphenyl)-3-(2-oxidanylidene-1-phenacyl-5-phenyl-3H-1,4-benzodiazepin-3-yl)urea

Systemtic Name: 1-(3-methylphenyl)-3-(2-oxidanylidene-1-phenacyl-5-phenyl-3H-1,4-benzodiazepin-3-yl)urea Openeye Name: 1-(m-tolyl)-3-(2-oxo-1-phenacyl-5-phenyl-3H-1,4-benzodiazepin-3-yl)urea CAS Name: 1-(3-methylphenyl)-3-(2-oxo-1-phenacyl-5-phenyl-3H-1,4-benzodiazepin-3-yl)urea IUPAC Name: 1-(3-methylphenyl)-3-(2-oxo-1-phenacyl-5-phenyl-3H-1,4-benzodiazepin-3-yl)urea Traditional Name: 1-(2-keto-1-phenacyl-5-phenyl-3H-1,4-benzodiazepin-3-yl)-3-(m-tolyl)urea Formula: C31H26N4O3 MolecularWeight: 502.56314

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)NC2C(=O)N(C3=CC=CC=C3C(=N2)C4=CC=CC=C4)CC(=O)C5=CC=CC=C5

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)NC2C(=O)N(C3=CC=CC=C3C(=N2)C4=CC=CC=C4)CC(=O)C5=CC=CC=C5

InChI

InChI=1S/C31H26N4O3/c1-21-11-10-16-24(19-21)32-31(38)34-29-30(37)35(20-27(36)22-12-4-2-5-13-22)26-18-9-8-17-25(26)28(33-29)23-14-6-3-7-15-23/h2-19,29H,20H2,1H3,(H2,32,34,38)