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

Systemtic Name: 2-[4-[3-(6-fluoranyl-3-methyl-1-benzothiophen-2-yl)-5-methoxy-pentyl]sulfanyl-2-methyl-phenoxy]ethanoic acid Openeye Name: 2-[4-[3-(6-fluoro-3-methyl-benzothiophen-2-yl)-5-methoxy-pentyl]sulfanyl-2-methyl-phenoxy]acetic acid CAS Name: 2-[4-[[3-(6-fluoro-3-methyl-1-benzothiophen-2-yl)-5-methoxypentyl]thio]-2-methylphenoxy]acetic acid IUPAC Name: 2-[4-[3-(6-fluoro-3-methyl-1-benzothiophen-2-yl)-5-methoxypentyl]sulfanyl-2-methylphenoxy]acetic acid Traditional Name: 2-[4-[[3-(6-fluoro-3-methyl-benzothiophen-2-yl)-5-methoxy-pentyl]thio]-2-methyl-phenoxy]acetic acid Formula: C24H27FO4S2 MolecularWeight: 462.597183

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H27FO4S2/c1-15-12-19(5-7-21(15)29-14-23(26)27)30-11-9-17(8-10-28-3)24-16(2)20-6-4-18(25)13-22(20)31-24/h4-7,12-13,17H,8-11,14H2,1-3H3,(H,26,27)