methyl 2-sulfanylidene-6-(trifluoromethyl)-1H-pyridine-3-carboxylate

Systemtic Name: methyl 2-sulfanylidene-6-(trifluoromethyl)-1H-pyridine-3-carboxylate Openeye Name: methyl 2-thioxo-6-(trifluoromethyl)-1H-pyridine-3-carboxylate CAS Name: 2-sulfanylidene-6-(trifluoromethyl)-1H-pyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 2-sulfanylidene-6-(trifluoromethyl)-1H-pyridine-3-carboxylate Traditional Name: 2-thioxo-6-(trifluoromethyl)-1H-pyridine-3-carboxylic acid methyl ester Formula: C8H6F3NO2S MolecularWeight: 237.19895

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(NC1=S)C(F)(F)F

Isomeric SMILES

COC(=O)C1=CC=C(NC1=S)C(F)(F)F

InChI

InChI=1S/C8H6F3NO2S/c1-14-7(13)4-2-3-5(8(9,10)11)12-6(4)15/h2-3H,1H3,(H,12,15)