3-(4-chlorophenyl)-5-(4-fluorophenyl)-1-morpholin-4-ylcarbonyl-4-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 3-(4-chlorophenyl)-5-(4-fluorophenyl)-1-morpholin-4-ylcarbonyl-4-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxylic acid Openeye Name: 3-(4-chlorophenyl)-5-(4-fluorophenyl)-1-(morpholine-4-carbonyl)-4-(thiophene-2-carbonyl)pyrrolidine-2-carboxylic acid CAS Name: 3-(4-chlorophenyl)-5-(4-fluorophenyl)-1-[4-morpholinyl(oxo)methyl]-4-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 3-(4-chlorophenyl)-5-(4-fluorophenyl)-1-(morpholine-4-carbonyl)-4-(thiophene-2-carbonyl)pyrrolidine-2-carboxylic acid Traditional Name: 3-(4-chlorophenyl)-5-(4-fluorophenyl)-1-(morpholine-4-carbonyl)-4-(2-thenoyl)proline Formula: C27H24ClFN2O5S MolecularWeight: 543.006263

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(=O)N2C(C(C(C2C(=O)O)C3=CC=C(C=C3)Cl)C(=O)C4=CC=CS4)C5=CC=C(C=C5)F

Isomeric SMILES

C1COCCN1C(=O)N2C(C(C(C2C(=O)O)C3=CC=C(C=C3)Cl)C(=O)C4=CC=CS4)C5=CC=C(C=C5)F

InChI

InChI=1S/C27H24ClFN2O5S/c28-18-7-3-16(4-8-18)21-22(25(32)20-2-1-15-37-20)23(17-5-9-19(29)10-6-17)31(24(21)26(33)34)27(35)30-11-13-36-14-12-30/h1-10,15,21-24H,11-14H2,(H,33,34)