2-(7-bromanyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-1-yl)-N-[(E)-(phenylmethylidene)amino]ethanamide

Systemtic Name: 2-(7-bromanyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-1-yl)-N-[(E)-(phenylmethylidene)amino]ethanamide Openeye Name: N-[(E)-benzylideneamino]-2-(7-bromo-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)acetamide CAS Name: 2-(7-bromo-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)-N-[(E)-(phenylmethylene)amino]acetamide IUPAC Name: N-[(E)-benzylideneamino]-2-(7-bromo-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)acetamide Traditional Name: N-[(E)-benzalamino]-2-(7-bromo-2-keto-5-phenyl-3H-1,4-benzodiazepin-1-yl)acetamide Formula: C24H19BrN4O2 MolecularWeight: 475.33726

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=C(C=C(C=C2)Br)C(=N1)C3=CC=CC=C3)CC(=O)NN=CC4=CC=CC=C4

Isomeric SMILES

C1C(=O)N(C2=C(C=C(C=C2)Br)C(=N1)C3=CC=CC=C3)CC(=O)N/N=C/C4=CC=CC=C4

InChI

InChI=1S/C24H19BrN4O2/c25-19-11-12-21-20(13-19)24(18-9-5-2-6-10-18)26-15-23(31)29(21)16-22(30)28-27-14-17-7-3-1-4-8-17/h1-14H,15-16H2,(H,28,30)/b27-14+