2-(3-cyano-6,7-dimethyl-quinolin-2-yl)sulfanyl-N-phenyl-ethanamide

Systemtic Name: 2-(3-cyano-6,7-dimethyl-quinolin-2-yl)sulfanyl-N-phenyl-ethanamide Openeye Name: 2-[(3-cyano-6,7-dimethyl-2-quinolyl)sulfanyl]-N-phenyl-acetamide CAS Name: 2-[(3-cyano-6,7-dimethyl-2-quinolinyl)thio]-N-phenylacetamide IUPAC Name: 2-(3-cyano-6,7-dimethylquinolin-2-yl)sulfanyl-N-phenylacetamide Traditional Name: 2-[(3-cyano-6,7-dimethyl-2-quinolyl)thio]-N-phenyl-acetamide Formula: C20H17N3OS MolecularWeight: 347.43348

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C(=C1)C=C(C(=N2)SCC(=O)NC3=CC=CC=C3)C#N)C

Isomeric SMILES

CC1=C(C=C2C(=C1)C=C(C(=N2)SCC(=O)NC3=CC=CC=C3)C#N)C

InChI

InChI=1S/C20H17N3OS/c1-13-8-15-10-16(11-21)20(23-18(15)9-14(13)2)25-12-19(24)22-17-6-4-3-5-7-17/h3-10H,12H2,1-2H3,(H,22,24)