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

Systemtic Name: 2-(3-cyano-6,7-dimethoxy-quinolin-2-yl)sulfanyl-N-phenyl-ethanamide Openeye Name: 2-[(3-cyano-6,7-dimethoxy-2-quinolyl)sulfanyl]-N-phenyl-acetamide CAS Name: 2-[(3-cyano-6,7-dimethoxy-2-quinolinyl)thio]-N-phenylacetamide IUPAC Name: 2-(3-cyano-6,7-dimethoxyquinolin-2-yl)sulfanyl-N-phenylacetamide Traditional Name: 2-[(3-cyano-6,7-dimethoxy-2-quinolyl)thio]-N-phenyl-acetamide Formula: C20H17N3O3S MolecularWeight: 379.43228

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C=C(C(=N2)SCC(=O)NC3=CC=CC=C3)C#N)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C=C(C(=N2)SCC(=O)NC3=CC=CC=C3)C#N)OC

InChI

InChI=1S/C20H17N3O3S/c1-25-17-9-13-8-14(11-21)20(23-16(13)10-18(17)26-2)27-12-19(24)22-15-6-4-3-5-7-15/h3-10H,12H2,1-2H3,(H,22,24)