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

Systemtic Name: 3-(4-tert-butylphenyl)-1-cyclopropylcarbonyl-2-methyl-5-(3-methylthiophen-2-yl)-4-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxylic acid Openeye Name: 3-(4-tert-butylphenyl)-1-(cyclopropanecarbonyl)-2-methyl-5-(3-methyl-2-thienyl)-4-(thiophene-2-carbonyl)pyrrolidine-2-carboxylic acid CAS Name: 3-(4-tert-butylphenyl)-1-[cyclopropyl(oxo)methyl]-2-methyl-5-(3-methyl-2-thiophenyl)-4-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 3-(4-tert-butylphenyl)-1-(cyclopropanecarbonyl)-2-methyl-5-(3-methylthiophen-2-yl)-4-(thiophene-2-carbonyl)pyrrolidine-2-carboxylic acid Traditional Name: 3-(4-tert-butylphenyl)-1-(cyclopropanecarbonyl)-2-methyl-5-(3-methyl-2-thienyl)-4-(2-thenoyl)proline Formula: C30H33NO4S2 MolecularWeight: 535.71732

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C30H33NO4S2/c1-17-14-16-37-26(17)24-22(25(32)21-7-6-15-36-21)23(18-10-12-20(13-11-18)29(2,3)4)30(5,28(34)35)31(24)27(33)19-8-9-19/h6-7,10-16,19,22-24H,8-9H2,1-5H3,(H,34,35)