5-(2-methylsulfanylpyrimidin-4-yl)pentanoic acid

Systemtic Name: 5-(2-methylsulfanylpyrimidin-4-yl)pentanoic acid Openeye Name: 5-(2-methylsulfanylpyrimidin-4-yl)pentanoic acid CAS Name: 5-[2-(methylthio)-4-pyrimidinyl]pentanoic acid IUPAC Name: 5-(2-methylsulfanylpyrimidin-4-yl)pentanoic acid Traditional Name: 5-[2-(methylthio)pyrimidin-4-yl]valeric acid Formula: C10H14N2O2S MolecularWeight: 226.29536

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=CC(=N1)CCCCC(=O)O

Isomeric SMILES

CSC1=NC=CC(=N1)CCCCC(=O)O

InChI

InChI=1S/C10H14N2O2S/c1-15-10-11-7-6-8(12-10)4-2-3-5-9(13)14/h6-7H,2-5H2,1H3,(H,13,14)