2-(8-nitroquinolin-5-yl)sulfanyl-N-phenyl-ethanamide

Systemtic Name: 2-(8-nitroquinolin-5-yl)sulfanyl-N-phenyl-ethanamide Openeye Name: 2-[(8-nitro-5-quinolyl)sulfanyl]-N-phenyl-acetamide CAS Name: 2-[(8-nitro-5-quinolinyl)thio]-N-phenylacetamide IUPAC Name: 2-(8-nitroquinolin-5-yl)sulfanyl-N-phenylacetamide Traditional Name: 2-[(8-nitro-5-quinolyl)thio]-N-phenyl-acetamide Formula: C17H13N3O3S MolecularWeight: 339.36842

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)CSC2=C3C=CC=NC3=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)CSC2=C3C=CC=NC3=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C17H13N3O3S/c21-16(19-12-5-2-1-3-6-12)11-24-15-9-8-14(20(22)23)17-13(15)7-4-10-18-17/h1-10H,11H2,(H,19,21)