2-(3-cyano-6-ethyl-quinolin-2-yl)sulfanyl-N-[2-(trifluoromethyl)phenyl]ethanamide

Systemtic Name: 2-(3-cyano-6-ethyl-quinolin-2-yl)sulfanyl-N-[2-(trifluoromethyl)phenyl]ethanamide Openeye Name: 2-[(3-cyano-6-ethyl-2-quinolyl)sulfanyl]-N-[2-(trifluoromethyl)phenyl]acetamide CAS Name: 2-[(3-cyano-6-ethyl-2-quinolinyl)thio]-N-[2-(trifluoromethyl)phenyl]acetamide IUPAC Name: 2-(3-cyano-6-ethylquinolin-2-yl)sulfanyl-N-[2-(trifluoromethyl)phenyl]acetamide Traditional Name: 2-[(3-cyano-6-ethyl-2-quinolyl)thio]-N-[2-(trifluoromethyl)phenyl]acetamide Formula: C21H16F3N3OS MolecularWeight: 415.43145

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC(=O)NC3=CC=CC=C3C(F)(F)F

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(C(=C2)C#N)SCC(=O)NC3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C21H16F3N3OS/c1-2-13-7-8-17-14(9-13)10-15(11-25)20(27-17)29-12-19(28)26-18-6-4-3-5-16(18)21(22,23)24/h3-10H,2,12H2,1H3,(H,26,28)