2-pyrimidin-4-ylsulfanylethanoic acid

Systemtic Name: 2-pyrimidin-4-ylsulfanylethanoic acid Openeye Name: 2-pyrimidin-4-ylsulfanylacetic acid CAS Name: 2-(4-pyrimidinylthio)acetic acid IUPAC Name: 2-pyrimidin-4-ylsulfanylacetic acid Traditional Name: 2-(4-pyrimidylthio)acetic acid Formula: C6H6N2O2S MolecularWeight: 170.18904

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CN=C1SCC(=O)O

Isomeric SMILES

C1=CN=CN=C1SCC(=O)O

InChI

InChI=1S/C6H6N2O2S/c9-6(10)3-11-5-1-2-7-4-8-5/h1-2,4H,3H2,(H,9,10)