methyl 3-pyridin-4-ylsulfanylpropanoate

Systemtic Name: methyl 3-pyridin-4-ylsulfanylpropanoate Openeye Name: methyl 3-(4-pyridylsulfanyl)propanoate CAS Name: 3-(pyridin-4-ylthio)propanoic acid methyl ester IUPAC Name: methyl 3-pyridin-4-ylsulfanylpropanoate Traditional Name: 3-(4-pyridylthio)propionic acid methyl ester Formula: C9H11NO2S MolecularWeight: 197.25414

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCSC1=CC=NC=C1

Isomeric SMILES

COC(=O)CCSC1=CC=NC=C1

InChI

InChI=1S/C9H11NO2S/c1-12-9(11)4-7-13-8-2-5-10-6-3-8/h2-3,5-6H,4,7H2,1H3