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

Systemtic Name: 2-methylpropyl 2-[6-(4-chlorophenyl)-3-cyano-pyridin-2-yl]sulfanylethanoate Openeye Name: isobutyl 2-[[6-(4-chlorophenyl)-3-cyano-2-pyridyl]sulfanyl]acetate CAS Name: 2-[[6-(4-chlorophenyl)-3-cyano-2-pyridinyl]thio]acetic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 2-[6-(4-chlorophenyl)-3-cyanopyridin-2-yl]sulfanylacetate Traditional Name: 2-[[6-(4-chlorophenyl)-3-cyano-2-pyridyl]thio]acetic acid isobutyl ester Formula: C18H17ClN2O2S MolecularWeight: 360.85778

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H17ClN2O2S/c1-12(2)10-23-17(22)11-24-18-14(9-20)5-8-16(21-18)13-3-6-15(19)7-4-13/h3-8,12H,10-11H2,1-2H3