methyl 2-(3-ethanoyl-2-fluoranyl-1-methyl-4H-pyridin-4-yl)-2-methylsulfanyl-butanoate

Systemtic Name: methyl 2-(3-ethanoyl-2-fluoranyl-1-methyl-4H-pyridin-4-yl)-2-methylsulfanyl-butanoate Openeye Name: methyl 2-(3-acetyl-2-fluoro-1-methyl-4H-pyridin-4-yl)-2-methylsulfanyl-butanoate CAS Name: 2-(3-acetyl-2-fluoro-1-methyl-4H-pyridin-4-yl)-2-(methylthio)butanoic acid methyl ester IUPAC Name: methyl 2-(3-acetyl-2-fluoro-1-methyl-4H-pyridin-4-yl)-2-methylsulfanylbutanoate Traditional Name: 2-(3-acetyl-2-fluoro-1-methyl-4H-pyridin-4-yl)-2-(methylthio)butyric acid methyl ester Formula: C14H20FNO3S MolecularWeight: 301.376903

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1C=CN(C(=C1C(=O)C)F)C)(C(=O)OC)SC

Isomeric SMILES

CCC(C1C=CN(C(=C1C(=O)C)F)C)(C(=O)OC)SC

InChI

InChI=1S/C14H20FNO3S/c1-6-14(20-5,13(18)19-4)10-7-8-16(3)12(15)11(10)9(2)17/h7-8,10H,6H2,1-5H3