N-(1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)-3-phenylazanyl-propanamide

Systemtic Name: N-(1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)-3-phenylazanyl-propanamide Openeye Name: 3-anilino-N-(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)propanamide CAS Name: 3-anilino-N-(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)propanamide IUPAC Name: 3-anilino-N-(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)propanamide Traditional Name: 3-anilino-N-(2-keto-1-methyl-5-phenyl-3H-1,4-benzodiazepin-3-yl)propionamide Formula: C25H24N4O2 MolecularWeight: 412.48366

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)CCNC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)CCNC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H24N4O2/c1-29-21-15-9-8-14-20(21)23(18-10-4-2-5-11-18)28-24(25(29)31)27-22(30)16-17-26-19-12-6-3-7-13-19/h2-15,24,26H,16-17H2,1H3,(H,27,30)