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

Systemtic Name: 2-[4-(4-methylphenyl)-5-phenyl-1,3-oxazol-2-yl]-2-sulfanyl-ethanoic acid Openeye Name: 2-[5-phenyl-4-(p-tolyl)oxazol-2-yl]-2-sulfanyl-acetic acid CAS Name: 2-mercapto-2-[4-(4-methylphenyl)-5-phenyl-2-oxazolyl]acetic acid IUPAC Name: 2-[4-(4-methylphenyl)-5-phenyl-1,3-oxazol-2-yl]-2-sulfanylacetic acid Traditional Name: 2-mercapto-2-[5-phenyl-4-(p-tolyl)oxazol-2-yl]acetic acid Formula: C18H15NO3S MolecularWeight: 325.3816

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(OC(=N2)C(C(=O)O)S)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(OC(=N2)C(C(=O)O)S)C3=CC=CC=C3

InChI

InChI=1S/C18H15NO3S/c1-11-7-9-12(10-8-11)14-15(13-5-3-2-4-6-13)22-17(19-14)16(23)18(20)21/h2-10,16,23H,1H3,(H,20,21)