2-(4-aminocarbonyl-6-methyl-pyrimidin-2-yl)sulfanylethanoic acid

Systemtic Name: 2-(4-aminocarbonyl-6-methyl-pyrimidin-2-yl)sulfanylethanoic acid Openeye Name: 2-(4-carbamoyl-6-methyl-pyrimidin-2-yl)sulfanylacetic acid CAS Name: 2-[(4-carbamoyl-6-methyl-2-pyrimidinyl)thio]acetic acid IUPAC Name: 2-(4-carbamoyl-6-methylpyrimidin-2-yl)sulfanylacetic acid Traditional Name: 2-[(4-carbamoyl-6-methyl-pyrimidin-2-yl)thio]acetic acid Formula: C8H9N3O3S MolecularWeight: 227.24036

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C(=O)N)SCC(=O)O

Isomeric SMILES

CC1=NC(=NC(=C1)C(=O)N)SCC(=O)O

InChI

InChI=1S/C8H9N3O3S/c1-4-2-5(7(9)14)11-8(10-4)15-3-6(12)13/h2H,3H2,1H3,(H2,9,14)(H,12,13)