2-[(5-methyl-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanoic acid

Systemtic Name: 2-[(5-methyl-4-oxidanyl-6-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanoic acid Openeye Name: 2-[(4-hydroxy-5-methyl-6-oxo-1H-pyrimidin-2-yl)sulfanyl]acetic acid CAS Name: 2-[(4-hydroxy-5-methyl-6-oxo-1H-pyrimidin-2-yl)thio]acetic acid IUPAC Name: 2-[(4-hydroxy-5-methyl-6-oxo-1H-pyrimidin-2-yl)sulfanyl]acetic acid Traditional Name: 2-[(4-hydroxy-6-keto-5-methyl-1H-pyrimidin-2-yl)thio]acetic acid Formula: C7H8N2O4S MolecularWeight: 216.21442

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(NC1=O)SCC(=O)O)O

Isomeric SMILES

CC1=C(N=C(NC1=O)SCC(=O)O)O

InChI

InChI=1S/C7H8N2O4S/c1-3-5(12)8-7(9-6(3)13)14-2-4(10)11/h2H2,1H3,(H,10,11)(H2,8,9,12,13)