2-[4-[2-[3-[3-chloranyl-4-(trifluoromethyloxy)phenyl]-1,2,4-thiadiazol-5-yl]ethoxy]-2-methyl-phenyl]sulfanyl-2-methyl-propanoic acid

Systemtic Name: 2-[4-[2-[3-[3-chloranyl-4-(trifluoromethyloxy)phenyl]-1,2,4-thiadiazol-5-yl]ethoxy]-2-methyl-phenyl]sulfanyl-2-methyl-propanoic acid Openeye Name: 2-[4-[2-[3-[3-chloro-4-(trifluoromethoxy)phenyl]-1,2,4-thiadiazol-5-yl]ethoxy]-2-methyl-phenyl]sulfanyl-2-methyl-propanoic acid CAS Name: 2-[[4-[2-[3-[3-chloro-4-(trifluoromethoxy)phenyl]-1,2,4-thiadiazol-5-yl]ethoxy]-2-methylphenyl]thio]-2-methylpropanoic acid IUPAC Name: 2-[4-[2-[3-[3-chloro-4-(trifluoromethoxy)phenyl]-1,2,4-thiadiazol-5-yl]ethoxy]-2-methylphenyl]sulfanyl-2-methylpropanoic acid Traditional Name: 2-[[4-[2-[3-[3-chloro-4-(trifluoromethoxy)phenyl]-1,2,4-thiadiazol-5-yl]ethoxy]-2-methyl-phenyl]thio]-2-methyl-propionic acid Formula: C22H20ClF3N2O4S2 MolecularWeight: 532.98341

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCC2=NC(=NS2)C3=CC(=C(C=C3)OC(F)(F)F)Cl)SC(C)(C)C(=O)O

Isomeric SMILES

CC1=C(C=CC(=C1)OCCC2=NC(=NS2)C3=CC(=C(C=C3)OC(F)(F)F)Cl)SC(C)(C)C(=O)O

InChI

InChI=1S/C22H20ClF3N2O4S2/c1-12-10-14(5-7-17(12)33-21(2,3)20(29)30)31-9-8-18-27-19(28-34-18)13-4-6-16(15(23)11-13)32-22(24,25)26/h4-7,10-11H,8-9H2,1-3H3,(H,29,30)