2-[(4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]propanoic acid

Systemtic Name: 2-[(4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]propanoic acid Openeye Name: 2-[(4-hydroxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]propanoic acid CAS Name: 2-[(4-hydroxy-6-oxo-1H-pyrimidin-2-yl)thio]propanoic acid IUPAC Name: 2-[(4-hydroxy-6-oxo-1H-pyrimidin-2-yl)sulfanyl]propanoic acid Traditional Name: 2-[(4-hydroxy-6-keto-1H-pyrimidin-2-yl)thio]propionic acid Formula: C7H8N2O4S MolecularWeight: 216.21442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SC1=NC(=CC(=O)N1)O

Isomeric SMILES

CC(C(=O)O)SC1=NC(=CC(=O)N1)O

InChI

InChI=1S/C7H8N2O4S/c1-3(6(12)13)14-7-8-4(10)2-5(11)9-7/h2-3H,1H3,(H,12,13)(H2,8,9,10,11)