2-[4-[5-methoxy-3-[3-methyl-6-(trifluoromethyl)-1-benzothiophen-2-yl]pentyl]sulfanyl-2-methyl-phenoxy]ethanoic acid

Systemtic Name: 2-[4-[5-methoxy-3-[3-methyl-6-(trifluoromethyl)-1-benzothiophen-2-yl]pentyl]sulfanyl-2-methyl-phenoxy]ethanoic acid Openeye Name: 2-[4-[5-methoxy-3-[3-methyl-6-(trifluoromethyl)benzothiophen-2-yl]pentyl]sulfanyl-2-methyl-phenoxy]acetic acid CAS Name: 2-[4-[[5-methoxy-3-[3-methyl-6-(trifluoromethyl)-1-benzothiophen-2-yl]pentyl]thio]-2-methylphenoxy]acetic acid IUPAC Name: 2-[4-[5-methoxy-3-[3-methyl-6-(trifluoromethyl)-1-benzothiophen-2-yl]pentyl]sulfanyl-2-methylphenoxy]acetic acid Traditional Name: 2-[4-[[5-methoxy-3-[3-methyl-6-(trifluoromethyl)benzothiophen-2-yl]pentyl]thio]-2-methyl-phenoxy]acetic acid Formula: C25H27F3O4S2 MolecularWeight: 512.60469

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)SCCC(CCOC)C2=C(C3=C(S2)C=C(C=C3)C(F)(F)F)C)OCC(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)SCCC(CCOC)C2=C(C3=C(S2)C=C(C=C3)C(F)(F)F)C)OCC(=O)O

InChI

InChI=1S/C25H27F3O4S2/c1-15-12-19(5-7-21(15)32-14-23(29)30)33-11-9-17(8-10-31-3)24-16(2)20-6-4-18(25(26,27)28)13-22(20)34-24/h4-7,12-13,17H,8-11,14H2,1-3H3,(H,29,30)