methyl 2-[1-[(3-fluoranyl-4-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylethanoate

Systemtic Name: methyl 2-[1-[(3-fluoranyl-4-methyl-phenyl)amino]-1-oxidanylidene-propan-2-yl]sulfanylethanoate Openeye Name: methyl 2-[2-(3-fluoro-4-methyl-anilino)-1-methyl-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[1-(3-fluoro-4-methylanilino)-1-oxopropan-2-yl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[1-(3-fluoro-4-methylanilino)-1-oxopropan-2-yl]sulfanylacetate Traditional Name: 2-[[2-(3-fluoro-4-methyl-anilino)-2-keto-1-methyl-ethyl]thio]acetic acid methyl ester Formula: C13H16FNO3S MolecularWeight: 285.334443

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C(C)SCC(=O)OC)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C(C)SCC(=O)OC)F

InChI

InChI=1S/C13H16FNO3S/c1-8-4-5-10(6-11(8)14)15-13(17)9(2)19-7-12(16)18-3/h4-6,9H,7H2,1-3H3,(H,15,17)