3-(4-tert-butylphenyl)-5-(3-methylthiophen-2-yl)-1-(phenylcarbonyl)-4-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 3-(4-tert-butylphenyl)-5-(3-methylthiophen-2-yl)-1-(phenylcarbonyl)-4-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxylic acid Openeye Name: 1-benzoyl-3-(4-tert-butylphenyl)-5-(3-methyl-2-thienyl)-4-(thiophene-2-carbonyl)pyrrolidine-2-carboxylic acid CAS Name: 1-benzoyl-3-(4-tert-butylphenyl)-5-(3-methyl-2-thiophenyl)-4-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-benzoyl-3-(4-tert-butylphenyl)-5-(3-methylthiophen-2-yl)-4-(thiophene-2-carbonyl)pyrrolidine-2-carboxylic acid Traditional Name: 1-benzoyl-3-(4-tert-butylphenyl)-5-(3-methyl-2-thienyl)-4-(2-thenoyl)proline Formula: C32H31NO4S2 MolecularWeight: 557.72284

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C2C(C(C(N2C(=O)C3=CC=CC=C3)C(=O)O)C4=CC=C(C=C4)C(C)(C)C)C(=O)C5=CC=CS5

Isomeric SMILES

CC1=C(SC=C1)C2C(C(C(N2C(=O)C3=CC=CC=C3)C(=O)O)C4=CC=C(C=C4)C(C)(C)C)C(=O)C5=CC=CS5

InChI

InChI=1S/C32H31NO4S2/c1-19-16-18-39-29(19)26-25(28(34)23-11-8-17-38-23)24(20-12-14-22(15-13-20)32(2,3)4)27(31(36)37)33(26)30(35)21-9-6-5-7-10-21/h5-18,24-27H,1-4H3,(H,36,37)