3-[4-[[4-[2-(2-chloranyl-6-fluoranyl-phenyl)ethyl]-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]methoxy]-2-methyl-phenyl]propanoic acid

Systemtic Name: 3-[4-[[4-[2-(2-chloranyl-6-fluoranyl-phenyl)ethyl]-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]methoxy]-2-methyl-phenyl]propanoic acid Openeye Name: 3-[4-[[4-[2-(2-chloro-6-fluoro-phenyl)ethyl]-2-[4-(trifluoromethyl)phenyl]thiazol-5-yl]methoxy]-2-methyl-phenyl]propanoic acid CAS Name: 3-[4-[[4-[2-(2-chloro-6-fluorophenyl)ethyl]-2-[4-(trifluoromethyl)phenyl]-5-thiazolyl]methoxy]-2-methylphenyl]propanoic acid IUPAC Name: 3-[4-[[4-[2-(2-chloro-6-fluorophenyl)ethyl]-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]methoxy]-2-methylphenyl]propanoic acid Traditional Name: 3-[4-[[4-[2-(2-chloro-6-fluoro-phenyl)ethyl]-2-[4-(trifluoromethyl)phenyl]thiazol-5-yl]methoxy]-2-methyl-phenyl]propionic acid Formula: C29H24ClF4NO3S MolecularWeight: 578.017373

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCC2=C(N=C(S2)C3=CC=C(C=C3)C(F)(F)F)CCC4=C(C=CC=C4Cl)F)CCC(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)OCC2=C(N=C(S2)C3=CC=C(C=C3)C(F)(F)F)CCC4=C(C=CC=C4Cl)F)CCC(=O)O

InChI

InChI=1S/C29H24ClF4NO3S/c1-17-15-21(11-7-18(17)8-14-27(36)37)38-16-26-25(13-12-22-23(30)3-2-4-24(22)31)35-28(39-26)19-5-9-20(10-6-19)29(32,33)34/h2-7,9-11,15H,8,12-14,16H2,1H3,(H,36,37)