3,5-bis(4-chlorophenyl)-1-cyclopropylcarbonyl-2-methyl-4-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 3,5-bis(4-chlorophenyl)-1-cyclopropylcarbonyl-2-methyl-4-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxylic acid Openeye Name: 3,5-bis(4-chlorophenyl)-1-(cyclopropanecarbonyl)-2-methyl-4-(thiophene-2-carbonyl)pyrrolidine-2-carboxylic acid CAS Name: 3,5-bis(4-chlorophenyl)-1-[cyclopropyl(oxo)methyl]-2-methyl-4-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 3,5-bis(4-chlorophenyl)-1-(cyclopropanecarbonyl)-2-methyl-4-(thiophene-2-carbonyl)pyrrolidine-2-carboxylic acid Traditional Name: 3,5-bis(4-chlorophenyl)-1-(cyclopropanecarbonyl)-2-methyl-4-(2-thenoyl)proline Formula: C27H23Cl2NO4S MolecularWeight: 528.44682

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(C(C(N1C(=O)C2CC2)C3=CC=C(C=C3)Cl)C(=O)C4=CC=CS4)C5=CC=C(C=C5)Cl)C(=O)O

Isomeric SMILES

CC1(C(C(C(N1C(=O)C2CC2)C3=CC=C(C=C3)Cl)C(=O)C4=CC=CS4)C5=CC=C(C=C5)Cl)C(=O)O

InChI

InChI=1S/C27H23Cl2NO4S/c1-27(26(33)34)22(15-6-10-18(28)11-7-15)21(24(31)20-3-2-14-35-20)23(16-8-12-19(29)13-9-16)30(27)25(32)17-4-5-17/h2-3,6-14,17,21-23H,4-5H2,1H3,(H,33,34)