2-(7-bromanyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-1-yl)-N-phenethyl-ethanamide

Systemtic Name: 2-(7-bromanyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-1-yl)-N-phenethyl-ethanamide Openeye Name: 2-(7-bromo-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)-N-phenethyl-acetamide CAS Name: 2-(7-bromo-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)-N-phenethylacetamide IUPAC Name: 2-(7-bromo-2-oxo-5-phenyl-3H-1,4-benzodiazepin-1-yl)-N-phenethylacetamide Traditional Name: 2-(7-bromo-2-keto-5-phenyl-3H-1,4-benzodiazepin-1-yl)-N-phenethyl-acetamide Formula: C25H22BrN3O2 MolecularWeight: 476.36508

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)N(C2=C(C=C(C=C2)Br)C(=N1)C3=CC=CC=C3)CC(=O)NCCC4=CC=CC=C4

Isomeric SMILES

C1C(=O)N(C2=C(C=C(C=C2)Br)C(=N1)C3=CC=CC=C3)CC(=O)NCCC4=CC=CC=C4

InChI

InChI=1S/C25H22BrN3O2/c26-20-11-12-22-21(15-20)25(19-9-5-2-6-10-19)28-16-24(31)29(22)17-23(30)27-14-13-18-7-3-1-4-8-18/h1-12,15H,13-14,16-17H2,(H,27,30)