methyl 2-[6-(4-chlorophenyl)-3-cyano-pyridin-2-yl]sulfanylethanoate

Systemtic Name: methyl 2-[6-(4-chlorophenyl)-3-cyano-pyridin-2-yl]sulfanylethanoate Openeye Name: methyl 2-[[6-(4-chlorophenyl)-3-cyano-2-pyridyl]sulfanyl]acetate CAS Name: 2-[[6-(4-chlorophenyl)-3-cyano-2-pyridinyl]thio]acetic acid methyl ester IUPAC Name: methyl 2-[6-(4-chlorophenyl)-3-cyanopyridin-2-yl]sulfanylacetate Traditional Name: 2-[[6-(4-chlorophenyl)-3-cyano-2-pyridyl]thio]acetic acid methyl ester Formula: C15H11ClN2O2S MolecularWeight: 318.77804

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=C(C=CC(=N1)C2=CC=C(C=C2)Cl)C#N

Isomeric SMILES

COC(=O)CSC1=C(C=CC(=N1)C2=CC=C(C=C2)Cl)C#N

InChI

InChI=1S/C15H11ClN2O2S/c1-20-14(19)9-21-15-11(8-17)4-7-13(18-15)10-2-5-12(16)6-3-10/h2-7H,9H2,1H3