methyl 5-[[5-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]furan-2-carboxylate

Systemtic Name: methyl 5-[[5-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]furan-2-carboxylate Openeye Name: methyl 5-[[5-(trifluoromethyl)-2-pyridyl]sulfanylmethyl]furan-2-carboxylate CAS Name: 5-[[[5-(trifluoromethyl)-2-pyridinyl]thio]methyl]-2-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[5-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]furan-2-carboxylate Traditional Name: 5-[[[5-(trifluoromethyl)-2-pyridyl]thio]methyl]furan-2-carboxylic acid methyl ester Formula: C13H10F3NO3S MolecularWeight: 317.28361

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(O1)CSC2=NC=C(C=C2)C(F)(F)F

Isomeric SMILES

COC(=O)C1=CC=C(O1)CSC2=NC=C(C=C2)C(F)(F)F

InChI

InChI=1S/C13H10F3NO3S/c1-19-12(18)10-4-3-9(20-10)7-21-11-5-2-8(6-17-11)13(14,15)16/h2-6H,7H2,1H3