2-(3-cyano-6,7-dimethyl-quinolin-2-yl)sulfanylethanamide

Systemtic Name: 2-(3-cyano-6,7-dimethyl-quinolin-2-yl)sulfanylethanamide Openeye Name: 2-[(3-cyano-6,7-dimethyl-2-quinolyl)sulfanyl]acetamide CAS Name: 2-[(3-cyano-6,7-dimethyl-2-quinolinyl)thio]acetamide IUPAC Name: 2-(3-cyano-6,7-dimethylquinolin-2-yl)sulfanylacetamide Traditional Name: 2-[(3-cyano-6,7-dimethyl-2-quinolyl)thio]acetamide Formula: C14H13N3OS MolecularWeight: 271.33752

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13N3OS/c1-8-3-10-5-11(6-15)14(19-7-13(16)18)17-12(10)4-9(8)2/h3-5H,7H2,1-2H3,(H2,16,18)