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

Systemtic Name: 3-[4-[(1S)-1-[5-[(2-chloranyl-6-fluoranyl-phenoxy)methyl]-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-4-yl]ethoxy]-2-methyl-phenyl]propanoic acid Openeye Name: 3-[4-[(1S)-1-[5-[(2-chloro-6-fluoro-phenoxy)methyl]-2-[4-(trifluoromethyl)phenyl]thiazol-4-yl]ethoxy]-2-methyl-phenyl]propanoic acid CAS Name: 3-[4-[(1S)-1-[5-[(2-chloro-6-fluorophenoxy)methyl]-2-[4-(trifluoromethyl)phenyl]-4-thiazolyl]ethoxy]-2-methylphenyl]propanoic acid IUPAC Name: 3-[4-[(1S)-1-[5-[(2-chloro-6-fluorophenoxy)methyl]-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-4-yl]ethoxy]-2-methylphenyl]propanoic acid Traditional Name: 3-[4-[(1S)-1-[5-[(2-chloro-6-fluoro-phenoxy)methyl]-2-[4-(trifluoromethyl)phenyl]thiazol-4-yl]ethoxy]-2-methyl-phenyl]propionic acid Formula: C29H24ClF4NO4S MolecularWeight: 594.016773

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OC(C)C2=C(SC(=N2)C3=CC=C(C=C3)C(F)(F)F)COC4=C(C=CC=C4Cl)F)CCC(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)O[C@@H](C)C2=C(SC(=N2)C3=CC=C(C=C3)C(F)(F)F)COC4=C(C=CC=C4Cl)F)CCC(=O)O

InChI

InChI=1S/C29H24ClF4NO4S/c1-16-14-21(12-8-18(16)9-13-25(36)37)39-17(2)26-24(15-38-27-22(30)4-3-5-23(27)31)40-28(35-26)19-6-10-20(11-7-19)29(32,33)34/h3-8,10-12,14,17H,9,13,15H2,1-2H3,(H,36,37)/t17-/m0/s1