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

Systemtic Name: methyl 3-[5-(trifluoromethyl)pyridin-2-yl]sulfanylpropanoate Openeye Name: methyl 3-[[5-(trifluoromethyl)-2-pyridyl]sulfanyl]propanoate CAS Name: 3-[[5-(trifluoromethyl)-2-pyridinyl]thio]propanoic acid methyl ester IUPAC Name: methyl 3-[5-(trifluoromethyl)pyridin-2-yl]sulfanylpropanoate Traditional Name: 3-[[5-(trifluoromethyl)-2-pyridyl]thio]propionic acid methyl ester Formula: C10H10F3NO2S MolecularWeight: 265.25211

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCSC1=NC=C(C=C1)C(F)(F)F

Isomeric SMILES

COC(=O)CCSC1=NC=C(C=C1)C(F)(F)F

InChI

InChI=1S/C10H10F3NO2S/c1-16-9(15)4-5-17-8-3-2-7(6-14-8)10(11,12)13/h2-3,6H,4-5H2,1H3