2-(3-cyano-6-ethoxy-quinolin-2-yl)sulfanyl-N-(3-ethanoylphenyl)ethanamide

Systemtic Name: 2-(3-cyano-6-ethoxy-quinolin-2-yl)sulfanyl-N-(3-ethanoylphenyl)ethanamide Openeye Name: N-(3-acetylphenyl)-2-[(3-cyano-6-ethoxy-2-quinolyl)sulfanyl]acetamide CAS Name: N-(3-acetylphenyl)-2-[(3-cyano-6-ethoxy-2-quinolinyl)thio]acetamide IUPAC Name: N-(3-acetylphenyl)-2-(3-cyano-6-ethoxyquinolin-2-yl)sulfanylacetamide Traditional Name: N-(3-acetylphenyl)-2-[(3-cyano-6-ethoxy-2-quinolyl)thio]acetamide Formula: C22H19N3O3S MolecularWeight: 405.46956

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC(=O)NC3=CC=CC(=C3)C(=O)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC(=O)NC3=CC=CC(=C3)C(=O)C

InChI

InChI=1S/C22H19N3O3S/c1-3-28-19-7-8-20-16(11-19)9-17(12-23)22(25-20)29-13-21(27)24-18-6-4-5-15(10-18)14(2)26/h4-11H,3,13H2,1-2H3,(H,24,27)