(4-chloranyl-2-methylsulfanyl-pyrimidin-5-yl) propanoate

Systemtic Name: (4-chloranyl-2-methylsulfanyl-pyrimidin-5-yl) propanoate Openeye Name: (4-chloro-2-methylsulfanyl-pyrimidin-5-yl) propanoate CAS Name: propanoic acid [4-chloro-2-(methylthio)-5-pyrimidinyl] ester IUPAC Name: (4-chloro-2-methylsulfanylpyrimidin-5-yl) propanoate Traditional Name: propionic acid [4-chloro-2-(methylthio)pyrimidin-5-yl] ester Formula: C8H9ClN2O2S MolecularWeight: 232.68726

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1=CN=C(N=C1Cl)SC

Isomeric SMILES

CCC(=O)OC1=CN=C(N=C1Cl)SC

InChI

InChI=1S/C8H9ClN2O2S/c1-3-6(12)13-5-4-10-8(14-2)11-7(5)9/h4H,3H2,1-2H3