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

Systemtic Name: 2-(4-methoxyphenyl)-3-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]-2-(phenylmethylsulfanyl)propanoic acid Openeye Name: 2-benzylsulfanyl-2-(4-methoxyphenyl)-3-[(5-methyl-2-phenyl-oxazol-4-yl)methoxy]propanoic acid CAS Name: 2-(4-methoxyphenyl)-3-[(5-methyl-2-phenyl-4-oxazolyl)methoxy]-2-(phenylmethylthio)propanoic acid IUPAC Name: 2-benzylsulfanyl-2-(4-methoxyphenyl)-3-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methoxy]propanoic acid Traditional Name: 2-(benzylthio)-2-(4-methoxyphenyl)-3-[(5-methyl-2-phenyl-oxazol-4-yl)methoxy]propionic acid Formula: C28H27NO5S MolecularWeight: 489.58268

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=CC=C2)COCC(C3=CC=C(C=C3)OC)(C(=O)O)SCC4=CC=CC=C4

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=CC=C2)COCC(C3=CC=C(C=C3)OC)(C(=O)O)SCC4=CC=CC=C4

InChI

InChI=1S/C28H27NO5S/c1-20-25(29-26(34-20)22-11-7-4-8-12-22)17-33-19-28(27(30)31,23-13-15-24(32-2)16-14-23)35-18-21-9-5-3-6-10-21/h3-16H,17-19H2,1-2H3,(H,30,31)