methyl 2-[3-(4-fluorophenyl)-3-oxidanylidene-propyl]sulfanylethanoate

Systemtic Name: methyl 2-[3-(4-fluorophenyl)-3-oxidanylidene-propyl]sulfanylethanoate Openeye Name: methyl 2-[3-(4-fluorophenyl)-3-oxo-propyl]sulfanylacetate CAS Name: 2-[[3-(4-fluorophenyl)-3-oxopropyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[3-(4-fluorophenyl)-3-oxopropyl]sulfanylacetate Traditional Name: 2-[[3-(4-fluorophenyl)-3-keto-propyl]thio]acetic acid methyl ester Formula: C12H13FO3S MolecularWeight: 256.293223

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSCCC(=O)C1=CC=C(C=C1)F

Isomeric SMILES

COC(=O)CSCCC(=O)C1=CC=C(C=C1)F

InChI

InChI=1S/C12H13FO3S/c1-16-12(15)8-17-7-6-11(14)9-2-4-10(13)5-3-9/h2-5H,6-8H2,1H3