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

Systemtic Name: 3-[4-(5-methyl-2-phenyl-1,3-oxazol-4-yl)phenyl]-2-methylsulfanyl-propanoic acid Openeye Name: 3-[4-(5-methyl-2-phenyl-oxazol-4-yl)phenyl]-2-methylsulfanyl-propanoic acid CAS Name: 3-[4-(5-methyl-2-phenyl-4-oxazolyl)phenyl]-2-(methylthio)propanoic acid IUPAC Name: 3-[4-(5-methyl-2-phenyl-1,3-oxazol-4-yl)phenyl]-2-methylsulfanylpropanoic acid Traditional Name: 3-[4-(5-methyl-2-phenyl-oxazol-4-yl)phenyl]-2-(methylthio)propionic acid Formula: C20H19NO3S MolecularWeight: 353.43476

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=CC=C2)C3=CC=C(C=C3)CC(C(=O)O)SC

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=CC=C2)C3=CC=C(C=C3)CC(C(=O)O)SC

InChI

InChI=1S/C20H19NO3S/c1-13-18(21-19(24-13)16-6-4-3-5-7-16)15-10-8-14(9-11-15)12-17(25-2)20(22)23/h3-11,17H,12H2,1-2H3,(H,22,23)