2-[4-[[4-(phenoxymethyl)-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]methylsulfanyl]phenoxy]propanoic acid

Systemtic Name: 2-[4-[[4-(phenoxymethyl)-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]methylsulfanyl]phenoxy]propanoic acid Openeye Name: 2-[4-[[4-(phenoxymethyl)-2-[4-(trifluoromethyl)phenyl]thiazol-5-yl]methylsulfanyl]phenoxy]propanoic acid CAS Name: 2-[4-[[4-(phenoxymethyl)-2-[4-(trifluoromethyl)phenyl]-5-thiazolyl]methylthio]phenoxy]propanoic acid IUPAC Name: 2-[4-[[4-(phenoxymethyl)-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]methylsulfanyl]phenoxy]propanoic acid Traditional Name: 2-[4-[[4-(phenoxymethyl)-2-[4-(trifluoromethyl)phenyl]thiazol-5-yl]methylthio]phenoxy]propionic acid Formula: C27H22F3NO4S2 MolecularWeight: 545.59309

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)OC1=CC=C(C=C1)SCC2=C(N=C(S2)C3=CC=C(C=C3)C(F)(F)F)COC4=CC=CC=C4

Isomeric SMILES

CC(C(=O)O)OC1=CC=C(C=C1)SCC2=C(N=C(S2)C3=CC=C(C=C3)C(F)(F)F)COC4=CC=CC=C4

InChI

InChI=1S/C27H22F3NO4S2/c1-17(26(32)33)35-21-11-13-22(14-12-21)36-16-24-23(15-34-20-5-3-2-4-6-20)31-25(37-24)18-7-9-19(10-8-18)27(28,29)30/h2-14,17H,15-16H2,1H3,(H,32,33)