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

Systemtic Name: 2-[4-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methylsulfanyl]-2-propyl-phenoxy]ethanoic acid Openeye Name: 2-[4-[(5-methyl-2-phenyl-oxazol-4-yl)methylsulfanyl]-2-propyl-phenoxy]acetic acid CAS Name: 2-[4-[(5-methyl-2-phenyl-4-oxazolyl)methylthio]-2-propylphenoxy]acetic acid IUPAC Name: 2-[4-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methylsulfanyl]-2-propylphenoxy]acetic acid Traditional Name: 2-[4-[(5-methyl-2-phenyl-oxazol-4-yl)methylthio]-2-propyl-phenoxy]acetic acid Formula: C22H23NO4S MolecularWeight: 397.48732

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)SCC2=C(OC(=N2)C3=CC=CC=C3)C)OCC(=O)O

Isomeric SMILES

CCCC1=C(C=CC(=C1)SCC2=C(OC(=N2)C3=CC=CC=C3)C)OCC(=O)O

InChI

InChI=1S/C22H23NO4S/c1-3-7-17-12-18(10-11-20(17)26-13-21(24)25)28-14-19-15(2)27-22(23-19)16-8-5-4-6-9-16/h4-6,8-12H,3,7,13-14H2,1-2H3,(H,24,25)