2-[[5-methyl-2-(2-methylphenyl)-1,3-oxazol-4-yl]methylsulfanyl]ethanoic acid

Systemtic Name: 2-[[5-methyl-2-(2-methylphenyl)-1,3-oxazol-4-yl]methylsulfanyl]ethanoic acid Openeye Name: 2-[[5-methyl-2-(o-tolyl)oxazol-4-yl]methylsulfanyl]acetic acid CAS Name: 2-[[5-methyl-2-(2-methylphenyl)-4-oxazolyl]methylthio]acetic acid IUPAC Name: 2-[[5-methyl-2-(2-methylphenyl)-1,3-oxazol-4-yl]methylsulfanyl]acetic acid Traditional Name: 2-[[5-methyl-2-(o-tolyl)oxazol-4-yl]methylthio]acetic acid Formula: C14H15NO3S MolecularWeight: 277.3388

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NC(=C(O2)C)CSCC(=O)O

Isomeric SMILES

CC1=CC=CC=C1C2=NC(=C(O2)C)CSCC(=O)O

InChI

InChI=1S/C14H15NO3S/c1-9-5-3-4-6-11(9)14-15-12(10(2)18-14)7-19-8-13(16)17/h3-6H,7-8H2,1-2H3,(H,16,17)