2-methylpropyl 3-(4-methylphenyl)carbonyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazolidine-4-carboxylate

Systemtic Name: 2-methylpropyl 3-(4-methylphenyl)carbonyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazolidine-4-carboxylate Openeye Name: isobutyl 3-(4-methylbenzoyl)-2-[4-(trifluoromethyl)phenyl]thiazolidine-4-carboxylate CAS Name: 3-[(4-methylphenyl)-oxomethyl]-2-[4-(trifluoromethyl)phenyl]-4-thiazolidinecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 3-(4-methylbenzoyl)-2-[4-(trifluoromethyl)phenyl]-1,3-thiazolidine-4-carboxylate Traditional Name: 3-p-toluoyl-2-[4-(trifluoromethyl)phenyl]thiazolidine-4-carboxylic acid isobutyl ester Formula: C23H24F3NO3S MolecularWeight: 451.50177

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2C(CSC2C3=CC=C(C=C3)C(F)(F)F)C(=O)OCC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2C(CSC2C3=CC=C(C=C3)C(F)(F)F)C(=O)OCC(C)C

InChI

InChI=1S/C23H24F3NO3S/c1-14(2)12-30-22(29)19-13-31-21(17-8-10-18(11-9-17)23(24,25)26)27(19)20(28)16-6-4-15(3)5-7-16/h4-11,14,19,21H,12-13H2,1-3H3