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

Systemtic Name: 3-(4-tert-butylphenyl)-2-methyl-5-(3-methylthiophen-2-yl)-1-(phenylcarbonyl)-4-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxylic acid Openeye Name: 1-benzoyl-3-(4-tert-butylphenyl)-2-methyl-5-(3-methyl-2-thienyl)-4-(thiophene-2-carbonyl)pyrrolidine-2-carboxylic acid CAS Name: 1-benzoyl-3-(4-tert-butylphenyl)-2-methyl-5-(3-methyl-2-thiophenyl)-4-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-benzoyl-3-(4-tert-butylphenyl)-2-methyl-5-(3-methylthiophen-2-yl)-4-(thiophene-2-carbonyl)pyrrolidine-2-carboxylic acid Traditional Name: 1-benzoyl-3-(4-tert-butylphenyl)-2-methyl-5-(3-methyl-2-thienyl)-4-(2-thenoyl)proline Formula: C33H33NO4S2 MolecularWeight: 571.74942

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C33H33NO4S2/c1-20-17-19-40-29(20)27-25(28(35)24-12-9-18-39-24)26(21-13-15-23(16-14-21)32(2,3)4)33(5,31(37)38)34(27)30(36)22-10-7-6-8-11-22/h6-19,25-27H,1-5H3,(H,37,38)