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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC=CC=C2)CC(C)OC3=CC=CC(=C3)CSCC(=O)O

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=CC=C2)CC(C)OC3=CC=CC(=C3)CSCC(=O)O

InChI

InChI=1S/C22H23NO4S/c1-15(26-19-10-6-7-17(12-19)13-28-14-21(24)25)11-20-16(2)27-22(23-20)18-8-4-3-5-9-18/h3-10,12,15H,11,13-14H2,1-2H3,(H,24,25)