2-(5-ethanoyl-4-methyl-pyrimidin-2-yl)sulfanylethanoic acid

Systemtic Name: 2-(5-ethanoyl-4-methyl-pyrimidin-2-yl)sulfanylethanoic acid Openeye Name: 2-(5-acetyl-4-methyl-pyrimidin-2-yl)sulfanylacetic acid CAS Name: 2-[(5-acetyl-4-methyl-2-pyrimidinyl)thio]acetic acid IUPAC Name: 2-(5-acetyl-4-methylpyrimidin-2-yl)sulfanylacetic acid Traditional Name: 2-[(5-acetyl-4-methyl-pyrimidin-2-yl)thio]acetic acid Formula: C9H10N2O3S MolecularWeight: 226.2523

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC=C1C(=O)C)SCC(=O)O

Isomeric SMILES

CC1=NC(=NC=C1C(=O)C)SCC(=O)O

InChI

InChI=1S/C9H10N2O3S/c1-5-7(6(2)12)3-10-9(11-5)15-4-8(13)14/h3H,4H2,1-2H3,(H,13,14)