methyl 2-[5-ethanoyl-6-fluoranyl-1-(phenylmethyl)-2H-pyridin-2-yl]-2-methylsulfanyl-ethanoate

Systemtic Name: methyl 2-[5-ethanoyl-6-fluoranyl-1-(phenylmethyl)-2H-pyridin-2-yl]-2-methylsulfanyl-ethanoate Openeye Name: methyl 2-(5-acetyl-1-benzyl-6-fluoro-2H-pyridin-2-yl)-2-methylsulfanyl-acetate CAS Name: 2-[5-acetyl-6-fluoro-1-(phenylmethyl)-2H-pyridin-2-yl]-2-(methylthio)acetic acid methyl ester IUPAC Name: methyl 2-(5-acetyl-1-benzyl-6-fluoro-2H-pyridin-2-yl)-2-methylsulfanylacetate Traditional Name: 2-(5-acetyl-1-benzyl-6-fluoro-2H-pyridin-2-yl)-2-(methylthio)acetic acid methyl ester Formula: C18H20FNO3S MolecularWeight: 349.419703

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(N(C(C=C1)C(C(=O)OC)SC)CC2=CC=CC=C2)F

Isomeric SMILES

CC(=O)C1=C(N(C(C=C1)C(C(=O)OC)SC)CC2=CC=CC=C2)F

InChI

InChI=1S/C18H20FNO3S/c1-12(21)14-9-10-15(16(24-3)18(22)23-2)20(17(14)19)11-13-7-5-4-6-8-13/h4-10,15-16H,11H2,1-3H3