1-(3,4-dichlorophenyl)carbonyl-2-(1H-imidazol-5-ylmethyl)-5-thiophen-2-yl-pyrrolidine-2,4-dicarboxylic acid

Systemtic Name: 1-(3,4-dichlorophenyl)carbonyl-2-(1H-imidazol-5-ylmethyl)-5-thiophen-2-yl-pyrrolidine-2,4-dicarboxylic acid Openeye Name: 1-(3,4-dichlorobenzoyl)-2-(1H-imidazol-5-ylmethyl)-5-(2-thienyl)pyrrolidine-2,4-dicarboxylic acid CAS Name: 1-[(3,4-dichlorophenyl)-oxomethyl]-2-(1H-imidazol-5-ylmethyl)-5-thiophen-2-ylpyrrolidine-2,4-dicarboxylic acid IUPAC Name: 1-(3,4-dichlorobenzoyl)-2-(1H-imidazol-5-ylmethyl)-5-thiophen-2-ylpyrrolidine-2,4-dicarboxylic acid Traditional Name: 1-(3,4-dichlorobenzoyl)-2-(1H-imidazol-5-ylmethyl)-5-(2-thienyl)pyrrolidine-2,4-dicarboxylic acid Formula: C21H17Cl2N3O5S MolecularWeight: 494.34778

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(N(C1(CC2=CN=CN2)C(=O)O)C(=O)C3=CC(=C(C=C3)Cl)Cl)C4=CC=CS4)C(=O)O

Isomeric SMILES

C1C(C(N(C1(CC2=CN=CN2)C(=O)O)C(=O)C3=CC(=C(C=C3)Cl)Cl)C4=CC=CS4)C(=O)O

InChI

InChI=1S/C21H17Cl2N3O5S/c22-14-4-3-11(6-15(14)23)18(27)26-17(16-2-1-5-32-16)13(19(28)29)8-21(26,20(30)31)7-12-9-24-10-25-12/h1-6,9-10,13,17H,7-8H2,(H,24,25)(H,28,29)(H,30,31)