[3-(trifluoromethyl)phenyl]methyl 2-methylsulfanylpyridine-3-carboxylate

Systemtic Name: [3-(trifluoromethyl)phenyl]methyl 2-methylsulfanylpyridine-3-carboxylate Openeye Name: [3-(trifluoromethyl)phenyl]methyl 2-methylsulfanylpyridine-3-carboxylate CAS Name: 2-(methylthio)-3-pyridinecarboxylic acid [3-(trifluoromethyl)phenyl]methyl ester IUPAC Name: [3-(trifluoromethyl)phenyl]methyl 2-methylsulfanylpyridine-3-carboxylate Traditional Name: 2-(methylthio)nicotinic acid [3-(trifluoromethyl)benzyl] ester Formula: C15H12F3NO2S MolecularWeight: 327.32149

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C=CC=N1)C(=O)OCC2=CC(=CC=C2)C(F)(F)F

Isomeric SMILES

CSC1=C(C=CC=N1)C(=O)OCC2=CC(=CC=C2)C(F)(F)F

InChI

InChI=1S/C15H12F3NO2S/c1-22-13-12(6-3-7-19-13)14(20)21-9-10-4-2-5-11(8-10)15(16,17)18/h2-8H,9H2,1H3