2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-2-methyl-propanoic acid

Systemtic Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-2-methyl-propanoic acid Openeye Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-2-methyl-propanoic acid CAS Name: 2-[(4,6-dimethyl-2-pyrimidinyl)thio]-2-methylpropanoic acid IUPAC Name: 2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-2-methylpropanoic acid Traditional Name: 2-[(4,6-dimethylpyrimidin-2-yl)thio]-2-methyl-propionic acid Formula: C10H14N2O2S MolecularWeight: 226.29536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC(C)(C)C(=O)O)C

Isomeric SMILES

CC1=CC(=NC(=N1)SC(C)(C)C(=O)O)C

InChI

InChI=1S/C10H14N2O2S/c1-6-5-7(2)12-9(11-6)15-10(3,4)8(13)14/h5H,1-4H3,(H,13,14)