2-(3-cyano-7-methyl-quinolin-2-yl)sulfanyl-N-[2-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-(3-cyano-7-methyl-quinolin-2-yl)sulfanyl-N-[2-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-[(3-cyano-7-methyl-2-quinolyl)sulfanyl]-N-[2-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[(3-cyano-7-methyl-2-quinolinyl)thio]-N-[2-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-(3-cyano-7-methylquinolin-2-yl)sulfanyl-N-[2-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[(3-cyano-7-methyl-2-quinolyl)thio]-N-[2-(trifluoromethyl)phenyl]acetamide Formula: C20H14F3N3OS MolecularWeight: 401.40487

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(C(=N2)SCC(=O)NC3=CC=CC=C3C(F)(F)F)C#N

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(C(=N2)SCC(=O)NC3=CC=CC=C3C(F)(F)F)C#N

InChI

InChI=1S/C20H14F3N3OS/c1-12-6-7-13-9-14(10-24)19(26-17(13)8-12)28-11-18(27)25-16-5-3-2-4-15(16)20(21,22)23/h2-9H,11H2,1H3,(H,25,27)