3-(2-ethanoylsulfanyl-4-oxidanylidene-4-phenyl-butanoyl)-2-[3-(trifluoromethyl)phenyl]-1,3-thiazolidine-4-carboxylic acid

Systemtic Name: 3-(2-ethanoylsulfanyl-4-oxidanylidene-4-phenyl-butanoyl)-2-[3-(trifluoromethyl)phenyl]-1,3-thiazolidine-4-carboxylic acid Openeye Name: 3-(2-acetylsulfanyl-4-oxo-4-phenyl-butanoyl)-2-[3-(trifluoromethyl)phenyl]thiazolidine-4-carboxylic acid CAS Name: 3-[2-(acetylthio)-1,4-dioxo-4-phenylbutyl]-2-[3-(trifluoromethyl)phenyl]-4-thiazolidinecarboxylic acid IUPAC Name: 3-(2-acetylsulfanyl-4-oxo-4-phenylbutanoyl)-2-[3-(trifluoromethyl)phenyl]-1,3-thiazolidine-4-carboxylic acid Traditional Name: 3-[2-(acetylthio)-4-keto-4-phenyl-butanoyl]-2-[3-(trifluoromethyl)phenyl]thiazolidine-4-carboxylic acid Formula: C23H20F3NO5S2 MolecularWeight: 511.53381

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC(CC(=O)C1=CC=CC=C1)C(=O)N2C(CSC2C3=CC(=CC=C3)C(F)(F)F)C(=O)O

Isomeric SMILES

CC(=O)SC(CC(=O)C1=CC=CC=C1)C(=O)N2C(CSC2C3=CC(=CC=C3)C(F)(F)F)C(=O)O

InChI

InChI=1S/C23H20F3NO5S2/c1-13(28)34-19(11-18(29)14-6-3-2-4-7-14)20(30)27-17(22(31)32)12-33-21(27)15-8-5-9-16(10-15)23(24,25)26/h2-10,17,19,21H,11-12H2,1H3,(H,31,32)