methyl 2-(2-pyridin-4-ylethylsulfanyl)ethanoate

Systemtic Name: methyl 2-(2-pyridin-4-ylethylsulfanyl)ethanoate Openeye Name: methyl 2-[2-(4-pyridyl)ethylsulfanyl]acetate CAS Name: 2-(2-pyridin-4-ylethylthio)acetic acid methyl ester IUPAC Name: methyl 2-(2-pyridin-4-ylethylsulfanyl)acetate Traditional Name: 2-[2-(4-pyridyl)ethylthio]acetic acid methyl ester Formula: C10H13NO2S MolecularWeight: 211.28072

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSCCC1=CC=NC=C1

Isomeric SMILES

COC(=O)CSCCC1=CC=NC=C1

InChI

InChI=1S/C10H13NO2S/c1-13-10(12)8-14-7-4-9-2-5-11-6-3-9/h2-3,5-6H,4,7-8H2,1H3