2-[2-(carboxymethylsulfanyl)pyrimidin-4-yl]sulfanylethanoic acid

Systemtic Name: 2-[2-(carboxymethylsulfanyl)pyrimidin-4-yl]sulfanylethanoic acid Openeye Name: 2-[2-(carboxymethylsulfanyl)pyrimidin-4-yl]sulfanylacetic acid CAS Name: 2-[[2-(carboxymethylthio)-4-pyrimidinyl]thio]acetic acid IUPAC Name: 2-[2-(carboxymethylsulfanyl)pyrimidin-4-yl]sulfanylacetic acid Traditional Name: 2-[[2-(carboxymethylthio)pyrimidin-4-yl]thio]acetic acid Formula: C8H8N2O4S2 MolecularWeight: 260.29012

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1SCC(=O)O)SCC(=O)O

Isomeric SMILES

C1=CN=C(N=C1SCC(=O)O)SCC(=O)O

InChI

InChI=1S/C8H8N2O4S2/c11-6(12)3-15-5-1-2-9-8(10-5)16-4-7(13)14/h1-2H,3-4H2,(H,11,12)(H,13,14)