ethyl 3-(4-hexylphenyl)carbonyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazolidine-4-carboxylate

Systemtic Name: ethyl 3-(4-hexylphenyl)carbonyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazolidine-4-carboxylate Openeye Name: ethyl 3-(4-hexylbenzoyl)-2-[4-(trifluoromethyl)phenyl]thiazolidine-4-carboxylate CAS Name: 3-[(4-hexylphenyl)-oxomethyl]-2-[4-(trifluoromethyl)phenyl]-4-thiazolidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(4-hexylbenzoyl)-2-[4-(trifluoromethyl)phenyl]-1,3-thiazolidine-4-carboxylate Traditional Name: 3-(4-hexylbenzoyl)-2-[4-(trifluoromethyl)phenyl]thiazolidine-4-carboxylic acid ethyl ester Formula: C26H30F3NO3S MolecularWeight: 493.58151

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(=O)N2C(CSC2C3=CC=C(C=C3)C(F)(F)F)C(=O)OCC

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(=O)N2C(CSC2C3=CC=C(C=C3)C(F)(F)F)C(=O)OCC

InChI

InChI=1S/C26H30F3NO3S/c1-3-5-6-7-8-18-9-11-19(12-10-18)23(31)30-22(25(32)33-4-2)17-34-24(30)20-13-15-21(16-14-20)26(27,28)29/h9-16,22,24H,3-8,17H2,1-2H3