N-(2-chloranyl-5-nitro-phenyl)-2-(3-phenylquinoxalin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-chloranyl-5-nitro-phenyl)-2-(3-phenylquinoxalin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2-chloro-5-nitro-phenyl)-2-(3-phenylquinoxalin-2-yl)sulfanyl-acetamide CAS Name: N-(2-chloro-5-nitrophenyl)-2-[(3-phenyl-2-quinoxalinyl)thio]acetamide IUPAC Name: N-(2-chloro-5-nitrophenyl)-2-(3-phenylquinoxalin-2-yl)sulfanylacetamide Traditional Name: N-(2-chloro-5-nitro-phenyl)-2-[(3-phenylquinoxalin-2-yl)thio]acetamide Formula: C22H15ClN4O3S MolecularWeight: 450.8975

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC3=CC=CC=C3N=C2SCC(=O)NC4=C(C=CC(=C4)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=NC3=CC=CC=C3N=C2SCC(=O)NC4=C(C=CC(=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C22H15ClN4O3S/c23-16-11-10-15(27(29)30)12-19(16)24-20(28)13-31-22-21(14-6-2-1-3-7-14)25-17-8-4-5-9-18(17)26-22/h1-12H,13H2,(H,24,28)