methyl 3-cyano-2-(thiophen-2-ylmethylsulfanyl)-6-(trifluoromethyl)pyridine-4-carboxylate

Systemtic Name: methyl 3-cyano-2-(thiophen-2-ylmethylsulfanyl)-6-(trifluoromethyl)pyridine-4-carboxylate Openeye Name: methyl 3-cyano-2-(2-thienylmethylsulfanyl)-6-(trifluoromethyl)pyridine-4-carboxylate CAS Name: 3-cyano-2-(thiophen-2-ylmethylthio)-6-(trifluoromethyl)-4-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 3-cyano-2-(thiophen-2-ylmethylsulfanyl)-6-(trifluoromethyl)pyridine-4-carboxylate Traditional Name: 3-cyano-2-(2-thenylthio)-6-(trifluoromethyl)isonicotinic acid methyl ester Formula: C14H9F3N2O2S2 MolecularWeight: 358.35867

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=NC(=C1C#N)SCC2=CC=CS2)C(F)(F)F

Isomeric SMILES

COC(=O)C1=CC(=NC(=C1C#N)SCC2=CC=CS2)C(F)(F)F

InChI

InChI=1S/C14H9F3N2O2S2/c1-21-13(20)9-5-11(14(15,16)17)19-12(10(9)6-18)23-7-8-3-2-4-22-8/h2-5H,7H2,1H3