methyl 2-methyl-3-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-propanoate

Systemtic Name: methyl 2-methyl-3-[5-(trifluoromethyl)pyridin-2-yl]sulfanyl-propanoate Openeye Name: methyl 2-methyl-3-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]propanoate CAS Name: 2-methyl-3-[[5-(trifluoromethyl)-2-pyridinyl]thio]propanoic acid methyl ester IUPAC Name: methyl 2-methyl-3-[5-(trifluoromethyl)pyridin-2-yl]sulfanylpropanoate Traditional Name: 2-methyl-3-[[5-(trifluoromethyl)-2-pyridyl]thio]propionic acid methyl ester Formula: C11H12F3NO2S MolecularWeight: 279.27869

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC1=NC=C(C=C1)C(F)(F)F)C(=O)OC

Isomeric SMILES

CC(CSC1=NC=C(C=C1)C(F)(F)F)C(=O)OC

InChI

InChI=1S/C11H12F3NO2S/c1-7(10(16)17-2)6-18-9-4-3-8(5-15-9)11(12,13)14/h3-5,7H,6H2,1-2H3