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

Systemtic Name: 3-(4-chlorophenyl)-1-cyclobutylcarbonyl-5-(4-fluorophenyl)-2-methyl-4-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxylic acid Openeye Name: 3-(4-chlorophenyl)-1-(cyclobutanecarbonyl)-5-(4-fluorophenyl)-2-methyl-4-(thiophene-2-carbonyl)pyrrolidine-2-carboxylic acid CAS Name: 3-(4-chlorophenyl)-1-[cyclobutyl(oxo)methyl]-5-(4-fluorophenyl)-2-methyl-4-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 3-(4-chlorophenyl)-1-(cyclobutanecarbonyl)-5-(4-fluorophenyl)-2-methyl-4-(thiophene-2-carbonyl)pyrrolidine-2-carboxylic acid Traditional Name: 3-(4-chlorophenyl)-1-(cyclobutanecarbonyl)-5-(4-fluorophenyl)-2-methyl-4-(2-thenoyl)proline Formula: C28H25ClFNO4S MolecularWeight: 526.018803

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C(N1C(=O)C2CCC2)C3=CC=C(C=C3)F)C(=O)C4=CC=CS4)C5=CC=C(C=C5)Cl)C(=O)O

Isomeric SMILES

CC1(C(C(C(N1C(=O)C2CCC2)C3=CC=C(C=C3)F)C(=O)C4=CC=CS4)C5=CC=C(C=C5)Cl)C(=O)O

InChI

InChI=1S/C28H25ClFNO4S/c1-28(27(34)35)23(16-7-11-19(29)12-8-16)22(25(32)21-6-3-15-36-21)24(17-9-13-20(30)14-10-17)31(28)26(33)18-4-2-5-18/h3,6-15,18,22-24H,2,4-5H2,1H3,(H,34,35)