N-(2-chlorophenyl)-2-(3-cyano-5,7-dimethyl-quinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-chlorophenyl)-2-(3-cyano-5,7-dimethyl-quinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(2-chlorophenyl)-2-[(3-cyano-5,7-dimethyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-(2-chlorophenyl)-2-[(3-cyano-5,7-dimethyl-2-quinolinyl)thio]acetamide IUPAC Name: N-(2-chlorophenyl)-2-(3-cyano-5,7-dimethylquinolin-2-yl)sulfanylacetamide Traditional Name: N-(2-chlorophenyl)-2-[(3-cyano-5,7-dimethyl-2-quinolyl)thio]acetamide Formula: C20H16ClN3OS MolecularWeight: 381.87854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=C(C(=NC2=C1)SCC(=O)NC3=CC=CC=C3Cl)C#N)C

Isomeric SMILES

CC1=CC(=C2C=C(C(=NC2=C1)SCC(=O)NC3=CC=CC=C3Cl)C#N)C

InChI

InChI=1S/C20H16ClN3OS/c1-12-7-13(2)15-9-14(10-22)20(24-18(15)8-12)26-11-19(25)23-17-6-4-3-5-16(17)21/h3-9H,11H2,1-2H3,(H,23,25)