2-(1-pyridin-4-ylpropylsulfanyl)ethanoic acid

Systemtic Name: 2-(1-pyridin-4-ylpropylsulfanyl)ethanoic acid Openeye Name: 2-[1-(4-pyridyl)propylsulfanyl]acetic acid CAS Name: 2-(1-pyridin-4-ylpropylthio)acetic acid IUPAC Name: 2-(1-pyridin-4-ylpropylsulfanyl)acetic acid Traditional Name: 2-[1-(4-pyridyl)propylthio]acetic acid Formula: C10H13NO2S MolecularWeight: 211.28072

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=NC=C1)SCC(=O)O

Isomeric SMILES

CCC(C1=CC=NC=C1)SCC(=O)O

InChI

InChI=1S/C10H13NO2S/c1-2-9(14-7-10(12)13)8-3-5-11-6-4-8/h3-6,9H,2,7H2,1H3,(H,12,13)