N-(3-chloranyl-2-methyl-phenyl)-2-(3-cyano-7-methyl-quinolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-2-(3-cyano-7-methyl-quinolin-2-yl)sulfanyl-ethanamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-2-[(3-cyano-7-methyl-2-quinolyl)sulfanyl]acetamide CAS Name: N-(3-chloro-2-methylphenyl)-2-[(3-cyano-7-methyl-2-quinolinyl)thio]acetamide IUPAC Name: N-(3-chloro-2-methylphenyl)-2-(3-cyano-7-methylquinolin-2-yl)sulfanylacetamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-2-[(3-cyano-7-methyl-2-quinolyl)thio]acetamide Formula: C20H16ClN3OS MolecularWeight: 381.87854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(C(=N2)SCC(=O)NC3=C(C(=CC=C3)Cl)C)C#N

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(C(=N2)SCC(=O)NC3=C(C(=CC=C3)Cl)C)C#N

InChI

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