2-(3-azanyl-3-oxidanylidene-propyl)-5-thiophen-2-yl-1-[4-(trifluoromethyl)phenyl]carbonyl-pyrrolidine-2,4-dicarboxylic acid

Systemtic Name: 2-(3-azanyl-3-oxidanylidene-propyl)-5-thiophen-2-yl-1-[4-(trifluoromethyl)phenyl]carbonyl-pyrrolidine-2,4-dicarboxylic acid Openeye Name: 2-(3-amino-3-oxo-propyl)-5-(2-thienyl)-1-[4-(trifluoromethyl)benzoyl]pyrrolidine-2,4-dicarboxylic acid CAS Name: 2-(3-amino-3-oxopropyl)-1-[oxo-[4-(trifluoromethyl)phenyl]methyl]-5-thiophen-2-ylpyrrolidine-2,4-dicarboxylic acid IUPAC Name: 2-(3-amino-3-oxopropyl)-5-thiophen-2-yl-1-[4-(trifluoromethyl)benzoyl]pyrrolidine-2,4-dicarboxylic acid Traditional Name: 2-(3-amino-3-keto-propyl)-5-(2-thienyl)-1-[4-(trifluoromethyl)benzoyl]pyrrolidine-2,4-dicarboxylic acid Formula: C21H19F3N2O6S MolecularWeight: 484.44557

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(N(C1(CCC(=O)N)C(=O)O)C(=O)C2=CC=C(C=C2)C(F)(F)F)C3=CC=CS3)C(=O)O

Isomeric SMILES

C1C(C(N(C1(CCC(=O)N)C(=O)O)C(=O)C2=CC=C(C=C2)C(F)(F)F)C3=CC=CS3)C(=O)O

InChI

InChI=1S/C21H19F3N2O6S/c22-21(23,24)12-5-3-11(4-6-12)17(28)26-16(14-2-1-9-33-14)13(18(29)30)10-20(26,19(31)32)8-7-15(25)27/h1-6,9,13,16H,7-8,10H2,(H2,25,27)(H,29,30)(H,31,32)