methyl 3-(pyridin-2-ylmethylsulfanyl)propanoate

Systemtic Name: methyl 3-(pyridin-2-ylmethylsulfanyl)propanoate Openeye Name: methyl 3-(2-pyridylmethylsulfanyl)propanoate CAS Name: 3-(2-pyridinylmethylthio)propanoic acid methyl ester IUPAC Name: methyl 3-(pyridin-2-ylmethylsulfanyl)propanoate Traditional Name: 3-(2-pyridylmethylthio)propionic acid methyl ester Formula: C10H13NO2S MolecularWeight: 211.28072

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCSCC1=CC=CC=N1

Isomeric SMILES

COC(=O)CCSCC1=CC=CC=N1

InChI

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