methyl 2-(4-cyano-2-fluoranyl-phenyl)sulfanylethanoate

Systemtic Name: methyl 2-(4-cyano-2-fluoranyl-phenyl)sulfanylethanoate Openeye Name: methyl 2-(4-cyano-2-fluoro-phenyl)sulfanylacetate CAS Name: 2-[(4-cyano-2-fluorophenyl)thio]acetic acid methyl ester IUPAC Name: methyl 2-(4-cyano-2-fluorophenyl)sulfanylacetate Traditional Name: 2-[(4-cyano-2-fluoro-phenyl)thio]acetic acid methyl ester Formula: C10H8FNO2S MolecularWeight: 225.239423

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=C(C=C(C=C1)C#N)F

Isomeric SMILES

COC(=O)CSC1=C(C=C(C=C1)C#N)F

InChI

InChI=1S/C10H8FNO2S/c1-14-10(13)6-15-9-3-2-7(5-12)4-8(9)11/h2-4H,6H2,1H3