N-(5-chloranyl-2-methyl-phenyl)-2-(3-cyano-6-methoxy-quinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(5-chloranyl-2-methyl-phenyl)-2-(3-cyano-6-methoxy-quinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(5-chloro-2-methyl-phenyl)-2-[(3-cyano-6-methoxy-2-quinolyl)sulfanyl]acetamide CAS Name: N-(5-chloro-2-methylphenyl)-2-[(3-cyano-6-methoxy-2-quinolinyl)thio]acetamide IUPAC Name: N-(5-chloro-2-methylphenyl)-2-(3-cyano-6-methoxyquinolin-2-yl)sulfanylacetamide Traditional Name: N-(5-chloro-2-methyl-phenyl)-2-[(3-cyano-6-methoxy-2-quinolyl)thio]acetamide Formula: C20H16ClN3O2S MolecularWeight: 397.87794

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)Cl)NC(=O)CSC2=NC3=C(C=C(C=C3)OC)C=C2C#N

Isomeric SMILES

CC1=C(C=C(C=C1)Cl)NC(=O)CSC2=NC3=C(C=C(C=C3)OC)C=C2C#N

InChI

InChI=1S/C20H16ClN3O2S/c1-12-3-4-15(21)9-18(12)23-19(25)11-27-20-14(10-22)7-13-8-16(26-2)5-6-17(13)24-20/h3-9H,11H2,1-2H3,(H,23,25)