2-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]ethanoic acid

Systemtic Name: 2-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]ethanoic acid Openeye Name: 2-(4,5-dimethyloxazol-2-yl)sulfanylacetic acid CAS Name: 2-[(4,5-dimethyl-2-oxazolyl)thio]acetic acid IUPAC Name: 2-[(4,5-dimethyl-1,3-oxazol-2-yl)sulfanyl]acetic acid Traditional Name: 2-[(4,5-dimethyloxazol-2-yl)thio]acetic acid Formula: C7H9NO3S MolecularWeight: 187.21626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC(=N1)SCC(=O)O)C

Isomeric SMILES

CC1=C(OC(=N1)SCC(=O)O)C

InChI

InChI=1S/C7H9NO3S/c1-4-5(2)11-7(8-4)12-3-6(9)10/h3H2,1-2H3,(H,9,10)