ethyl 2-(pyridin-4-ylmethylsulfanyl)propanoate

Systemtic Name: ethyl 2-(pyridin-4-ylmethylsulfanyl)propanoate Openeye Name: ethyl 2-(4-pyridylmethylsulfanyl)propanoate CAS Name: 2-(pyridin-4-ylmethylthio)propanoic acid ethyl ester IUPAC Name: ethyl 2-(pyridin-4-ylmethylsulfanyl)propanoate Traditional Name: 2-(4-pyridylmethylthio)propionic acid ethyl ester Formula: C11H15NO2S MolecularWeight: 225.3073

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C)SCC1=CC=NC=C1

Isomeric SMILES

CCOC(=O)C(C)SCC1=CC=NC=C1

InChI

InChI=1S/C11H15NO2S/c1-3-14-11(13)9(2)15-8-10-4-6-12-7-5-10/h4-7,9H,3,8H2,1-2H3