2-[3-chloranyl-4-[[4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]methylsulfanyl]phenyl]ethanoic acid

Systemtic Name: 2-[3-chloranyl-4-[[4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]methylsulfanyl]phenyl]ethanoic acid Openeye Name: 2-[3-chloro-4-[[4-methyl-2-[4-(trifluoromethyl)phenyl]thiazol-5-yl]methylsulfanyl]phenyl]acetic acid CAS Name: 2-[3-chloro-4-[[4-methyl-2-[4-(trifluoromethyl)phenyl]-5-thiazolyl]methylthio]phenyl]acetic acid IUPAC Name: 2-[3-chloro-4-[[4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]methylsulfanyl]phenyl]acetic acid Traditional Name: 2-[3-chloro-4-[[4-methyl-2-[4-(trifluoromethyl)phenyl]thiazol-5-yl]methylthio]phenyl]acetic acid Formula: C20H15ClF3NO2S2 MolecularWeight: 457.91681

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)C2=CC=C(C=C2)C(F)(F)F)CSC3=C(C=C(C=C3)CC(=O)O)Cl

Isomeric SMILES

CC1=C(SC(=N1)C2=CC=C(C=C2)C(F)(F)F)CSC3=C(C=C(C=C3)CC(=O)O)Cl

InChI

InChI=1S/C20H15ClF3NO2S2/c1-11-17(10-28-16-7-2-12(8-15(16)21)9-18(26)27)29-19(25-11)13-3-5-14(6-4-13)20(22,23)24/h2-8H,9-10H2,1H3,(H,26,27)