2-[3-[(4-chlorophenyl)carbamoylamino]-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-1-yl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[3-[(4-chlorophenyl)carbamoylamino]-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-1-yl]-N-(phenylmethyl)ethanamide Openeye Name: N-benzyl-2-[3-[(4-chlorophenyl)carbamoylamino]-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl]acetamide CAS Name: 2-[3-[[(4-chloroanilino)-oxomethyl]amino]-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl]-N-(phenylmethyl)acetamide IUPAC Name: N-benzyl-2-[3-[(4-chlorophenyl)carbamoylamino]-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl]acetamide Traditional Name: N-benzyl-2-[3-[(4-chlorophenyl)carbamoylamino]-2-keto-5-phenyl-3H-1,4-benzodiazepin-1-yl]acetamide Formula: C31H26ClN5O3 MolecularWeight: 552.02284

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)CN2C3=CC=CC=C3C(=NC(C2=O)NC(=O)NC4=CC=C(C=C4)Cl)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)CN2C3=CC=CC=C3C(=NC(C2=O)NC(=O)NC4=CC=C(C=C4)Cl)C5=CC=CC=C5

InChI

InChI=1S/C31H26ClN5O3/c32-23-15-17-24(18-16-23)34-31(40)36-29-30(39)37(20-27(38)33-19-21-9-3-1-4-10-21)26-14-8-7-13-25(26)28(35-29)22-11-5-2-6-12-22/h1-18,29H,19-20H2,(H,33,38)(H2,34,36,40)