ethyl (2S)-2-[3-cyano-6-(furan-2-yl)-4-(trifluoromethyl)pyridin-2-yl]sulfanylpropanoate

Systemtic Name: ethyl (2S)-2-[3-cyano-6-(furan-2-yl)-4-(trifluoromethyl)pyridin-2-yl]sulfanylpropanoate Openeye Name: ethyl (2S)-2-[[3-cyano-6-(2-furyl)-4-(trifluoromethyl)-2-pyridyl]sulfanyl]propanoate CAS Name: (2S)-2-[[3-cyano-6-(2-furanyl)-4-(trifluoromethyl)-2-pyridinyl]thio]propanoic acid ethyl ester IUPAC Name: ethyl (2S)-2-[3-cyano-6-(furan-2-yl)-4-(trifluoromethyl)pyridin-2-yl]sulfanylpropanoate Traditional Name: (2S)-2-[[3-cyano-6-(2-furyl)-4-(trifluoromethyl)-2-pyridyl]thio]propionic acid ethyl ester Formula: C16H13F3N2O3S MolecularWeight: 370.34623

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)SC1=C(C(=CC(=N1)C2=CC=CO2)C(F)(F)F)C#N

Isomeric SMILES

CCOC(=O)[C@H](C)SC1=C(C(=CC(=N1)C2=CC=CO2)C(F)(F)F)C#N

InChI

InChI=1S/C16H13F3N2O3S/c1-3-23-15(22)9(2)25-14-10(8-20)11(16(17,18)19)7-12(21-14)13-5-4-6-24-13/h4-7,9H,3H2,1-2H3/t9-/m0/s1