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

Systemtic Name: 2-[[4-(4-methylsulfanylphenyl)-5-phenyl-1,3-oxazol-2-yl]sulfanyl]ethanoic acid Openeye Name: 2-[4-(4-methylsulfanylphenyl)-5-phenyl-oxazol-2-yl]sulfanylacetic acid CAS Name: 2-[[4-[4-(methylthio)phenyl]-5-phenyl-2-oxazolyl]thio]acetic acid IUPAC Name: 2-[[4-(4-methylsulfanylphenyl)-5-phenyl-1,3-oxazol-2-yl]sulfanyl]acetic acid Traditional Name: 2-[[4-[4-(methylthio)phenyl]-5-phenyl-oxazol-2-yl]thio]acetic acid Formula: C18H15NO3S2 MolecularWeight: 357.4466

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2=C(OC(=N2)SCC(=O)O)C3=CC=CC=C3

Isomeric SMILES

CSC1=CC=C(C=C1)C2=C(OC(=N2)SCC(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C18H15NO3S2/c1-23-14-9-7-12(8-10-14)16-17(13-5-3-2-4-6-13)22-18(19-16)24-11-15(20)21/h2-10H,11H2,1H3,(H,20,21)