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

Systemtic Name: 2-[4-(4-methylphenyl)-1,3-oxazol-2-yl]-2-sulfanyl-ethanoic acid Openeye Name: 2-[4-(p-tolyl)oxazol-2-yl]-2-sulfanyl-acetic acid CAS Name: 2-mercapto-2-[4-(4-methylphenyl)-2-oxazolyl]acetic acid IUPAC Name: 2-[4-(4-methylphenyl)-1,3-oxazol-2-yl]-2-sulfanylacetic acid Traditional Name: 2-mercapto-2-[4-(p-tolyl)oxazol-2-yl]acetic acid Formula: C12H11NO3S MolecularWeight: 249.28564

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=COC(=N2)C(C(=O)O)S

Isomeric SMILES

CC1=CC=C(C=C1)C2=COC(=N2)C(C(=O)O)S

InChI

InChI=1S/C12H11NO3S/c1-7-2-4-8(5-3-7)9-6-16-11(13-9)10(17)12(14)15/h2-6,10,17H,1H3,(H,14,15)