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

Systemtic Name: 2-[[4-(4-methylsulfanylphenyl)-5-phenyl-1,3-oxazol-2-yl]sulfanyl]propanoic acid Openeye Name: 2-[4-(4-methylsulfanylphenyl)-5-phenyl-oxazol-2-yl]sulfanylpropanoic acid CAS Name: 2-[[4-[4-(methylthio)phenyl]-5-phenyl-2-oxazolyl]thio]propanoic acid IUPAC Name: 2-[[4-(4-methylsulfanylphenyl)-5-phenyl-1,3-oxazol-2-yl]sulfanyl]propanoic acid Traditional Name: 2-[[4-[4-(methylthio)phenyl]-5-phenyl-oxazol-2-yl]thio]propionic acid Formula: C19H17NO3S2 MolecularWeight: 371.47318

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)SC1=NC(=C(O1)C2=CC=CC=C2)C3=CC=C(C=C3)SC

Isomeric SMILES

CC(C(=O)O)SC1=NC(=C(O1)C2=CC=CC=C2)C3=CC=C(C=C3)SC

InChI

InChI=1S/C19H17NO3S2/c1-12(18(21)22)25-19-20-16(13-8-10-15(24-2)11-9-13)17(23-19)14-6-4-3-5-7-14/h3-12H,1-2H3,(H,21,22)