3-(4-chlorophenyl)-1-cyclohexylcarbonyl-5-(3-methylthiophen-2-yl)-4-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 3-(4-chlorophenyl)-1-cyclohexylcarbonyl-5-(3-methylthiophen-2-yl)-4-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxylic acid Openeye Name: 3-(4-chlorophenyl)-1-(cyclohexanecarbonyl)-5-(3-methyl-2-thienyl)-4-(thiophene-2-carbonyl)pyrrolidine-2-carboxylic acid CAS Name: 3-(4-chlorophenyl)-1-[cyclohexyl(oxo)methyl]-5-(3-methyl-2-thiophenyl)-4-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 3-(4-chlorophenyl)-1-(cyclohexanecarbonyl)-5-(3-methylthiophen-2-yl)-4-(thiophene-2-carbonyl)pyrrolidine-2-carboxylic acid Traditional Name: 3-(4-chlorophenyl)-1-(cyclohexanecarbonyl)-5-(3-methyl-2-thienyl)-4-(2-thenoyl)proline Formula: C28H28ClNO4S2 MolecularWeight: 542.10922

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C2C(C(C(N2C(=O)C3CCCCC3)C(=O)O)C4=CC=C(C=C4)Cl)C(=O)C5=CC=CS5

Isomeric SMILES

CC1=C(SC=C1)C2C(C(C(N2C(=O)C3CCCCC3)C(=O)O)C4=CC=C(C=C4)Cl)C(=O)C5=CC=CS5

InChI

InChI=1S/C28H28ClNO4S2/c1-16-13-15-36-26(16)23-22(25(31)20-8-5-14-35-20)21(17-9-11-19(29)12-10-17)24(28(33)34)30(23)27(32)18-6-3-2-4-7-18/h5,8-15,18,21-24H,2-4,6-7H2,1H3,(H,33,34)