methyl 3-(4-ethylphenyl)carbonyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazolidine-4-carboxylate

Systemtic Name: methyl 3-(4-ethylphenyl)carbonyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazolidine-4-carboxylate Openeye Name: methyl 3-(4-ethylbenzoyl)-2-[4-(trifluoromethyl)phenyl]thiazolidine-4-carboxylate CAS Name: 3-[(4-ethylphenyl)-oxomethyl]-2-[4-(trifluoromethyl)phenyl]-4-thiazolidinecarboxylic acid methyl ester IUPAC Name: methyl 3-(4-ethylbenzoyl)-2-[4-(trifluoromethyl)phenyl]-1,3-thiazolidine-4-carboxylate Traditional Name: 3-(4-ethylbenzoyl)-2-[4-(trifluoromethyl)phenyl]thiazolidine-4-carboxylic acid methyl ester Formula: C21H20F3NO3S MolecularWeight: 423.44861

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N2C(CSC2C3=CC=C(C=C3)C(F)(F)F)C(=O)OC

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N2C(CSC2C3=CC=C(C=C3)C(F)(F)F)C(=O)OC

InChI

InChI=1S/C21H20F3NO3S/c1-3-13-4-6-14(7-5-13)18(26)25-17(20(27)28-2)12-29-19(25)15-8-10-16(11-9-15)21(22,23)24/h4-11,17,19H,3,12H2,1-2H3