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

Systemtic Name: 2-methylpropyl 3-(3-bromophenyl)carbonyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazolidine-4-carboxylate Openeye Name: isobutyl 3-(3-bromobenzoyl)-2-[4-(trifluoromethyl)phenyl]thiazolidine-4-carboxylate CAS Name: 3-[(3-bromophenyl)-oxomethyl]-2-[4-(trifluoromethyl)phenyl]-4-thiazolidinecarboxylic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl 3-(3-bromobenzoyl)-2-[4-(trifluoromethyl)phenyl]-1,3-thiazolidine-4-carboxylate Traditional Name: 3-(3-bromobenzoyl)-2-[4-(trifluoromethyl)phenyl]thiazolidine-4-carboxylic acid isobutyl ester Formula: C22H21BrF3NO3S MolecularWeight: 516.37125

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)C1CSC(N1C(=O)C2=CC(=CC=C2)Br)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CC(C)COC(=O)C1CSC(N1C(=O)C2=CC(=CC=C2)Br)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C22H21BrF3NO3S/c1-13(2)11-30-21(29)18-12-31-20(14-6-8-16(9-7-14)22(24,25)26)27(18)19(28)15-4-3-5-17(23)10-15/h3-10,13,18,20H,11-12H2,1-2H3