3-(4-pentylphenyl)carbonyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazolidine-4-carboxylic acid

Systemtic Name: 3-(4-pentylphenyl)carbonyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazolidine-4-carboxylic acid Openeye Name: 3-(4-pentylbenzoyl)-2-[4-(trifluoromethyl)phenyl]thiazolidine-4-carboxylic acid CAS Name: 3-[oxo-(4-pentylphenyl)methyl]-2-[4-(trifluoromethyl)phenyl]-4-thiazolidinecarboxylic acid IUPAC Name: 3-(4-pentylbenzoyl)-2-[4-(trifluoromethyl)phenyl]-1,3-thiazolidine-4-carboxylic acid Traditional Name: 3-(4-amylbenzoyl)-2-[4-(trifluoromethyl)phenyl]thiazolidine-4-carboxylic acid Formula: C23H24F3NO3S MolecularWeight: 451.50177

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)N2C(CSC2C3=CC=C(C=C3)C(F)(F)F)C(=O)O

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)N2C(CSC2C3=CC=C(C=C3)C(F)(F)F)C(=O)O

InChI

InChI=1S/C23H24F3NO3S/c1-2-3-4-5-15-6-8-16(9-7-15)20(28)27-19(22(29)30)14-31-21(27)17-10-12-18(13-11-17)23(24,25)26/h6-13,19,21H,2-5,14H2,1H3,(H,29,30)