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

Systemtic Name: 3-(4-tert-butylphenyl)-1-cyclopropylcarbonyl-5-(3-methylthiophen-2-yl)-4-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxylic acid Openeye Name: 3-(4-tert-butylphenyl)-1-(cyclopropanecarbonyl)-5-(3-methyl-2-thienyl)-4-(thiophene-2-carbonyl)pyrrolidine-2-carboxylic acid CAS Name: 3-(4-tert-butylphenyl)-1-[cyclopropyl(oxo)methyl]-5-(3-methyl-2-thiophenyl)-4-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 3-(4-tert-butylphenyl)-1-(cyclopropanecarbonyl)-5-(3-methylthiophen-2-yl)-4-(thiophene-2-carbonyl)pyrrolidine-2-carboxylic acid Traditional Name: 3-(4-tert-butylphenyl)-1-(cyclopropanecarbonyl)-5-(3-methyl-2-thienyl)-4-(2-thenoyl)proline Formula: C29H31NO4S2 MolecularWeight: 521.69074

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C2C(C(C(N2C(=O)C3CC3)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)C3CC3)C(=O)O)C4=CC=C(C=C4)C(C)(C)C)C(=O)C5=CC=CS5

InChI

InChI=1S/C29H31NO4S2/c1-16-13-15-36-26(16)23-22(25(31)20-6-5-14-35-20)21(17-9-11-19(12-10-17)29(2,3)4)24(28(33)34)30(23)27(32)18-7-8-18/h5-6,9-15,18,21-24H,7-8H2,1-4H3,(H,33,34)