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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CSC(N1C(=O)C2=CC=C(C=C2)C(F)(F)F)CCC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1CSC(N1C(=O)C2=CC=C(C=C2)C(F)(F)F)CCC3=CC=CC=C3

InChI

InChI=1S/C21H20F3NO3S/c1-28-20(27)17-13-29-18(12-7-14-5-3-2-4-6-14)25(17)19(26)15-8-10-16(11-9-15)21(22,23)24/h2-6,8-11,17-18H,7,12-13H2,1H3