2-cyclopentyl-2-(4,5-dimethoxypyrimidin-2-yl)sulfanyl-ethanoic acid

Systemtic Name: 2-cyclopentyl-2-(4,5-dimethoxypyrimidin-2-yl)sulfanyl-ethanoic acid Openeye Name: 2-cyclopentyl-2-(4,5-dimethoxypyrimidin-2-yl)sulfanyl-acetic acid CAS Name: 2-cyclopentyl-2-[(4,5-dimethoxy-2-pyrimidinyl)thio]acetic acid IUPAC Name: 2-cyclopentyl-2-(4,5-dimethoxypyrimidin-2-yl)sulfanylacetic acid Traditional Name: 2-cyclopentyl-2-[(4,5-dimethoxypyrimidin-2-yl)thio]acetic acid Formula: C13H18N2O4S MolecularWeight: 298.35802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CN=C(N=C1OC)SC(C2CCCC2)C(=O)O

Isomeric SMILES

COC1=CN=C(N=C1OC)SC(C2CCCC2)C(=O)O

InChI

InChI=1S/C13H18N2O4S/c1-18-9-7-14-13(15-11(9)19-2)20-10(12(16)17)8-5-3-4-6-8/h7-8,10H,3-6H2,1-2H3,(H,16,17)