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

Systemtic Name: 2-[[3-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]methylsulfanyl]propanoic acid Openeye Name: 2-[[3-[2-(5-methyl-2-phenyl-oxazol-4-yl)ethoxy]phenyl]methylsulfanyl]propanoic acid CAS Name: 2-[[3-[2-(5-methyl-2-phenyl-4-oxazolyl)ethoxy]phenyl]methylthio]propanoic acid IUPAC Name: 2-[[3-[2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)ethoxy]phenyl]methylsulfanyl]propanoic acid Traditional Name: 2-[[3-[2-(5-methyl-2-phenyl-oxazol-4-yl)ethoxy]benzyl]thio]propionic 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)CCOC3=CC=CC(=C3)CSC(C)C(=O)O

Isomeric SMILES

CC1=C(N=C(O1)C2=CC=CC=C2)CCOC3=CC=CC(=C3)CSC(C)C(=O)O

InChI

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