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

Systemtic Name: 3-(4-tert-butylphenyl)-1-(2-methoxyethanoyl)-2-methyl-5-(3-methylthiophen-2-yl)-4-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxylic acid Openeye Name: 3-(4-tert-butylphenyl)-1-(2-methoxyacetyl)-2-methyl-5-(3-methyl-2-thienyl)-4-(thiophene-2-carbonyl)pyrrolidine-2-carboxylic acid CAS Name: 3-(4-tert-butylphenyl)-1-(2-methoxy-1-oxoethyl)-2-methyl-5-(3-methyl-2-thiophenyl)-4-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 3-(4-tert-butylphenyl)-1-(2-methoxyacetyl)-2-methyl-5-(3-methylthiophen-2-yl)-4-(thiophene-2-carbonyl)pyrrolidine-2-carboxylic acid Traditional Name: 3-(4-tert-butylphenyl)-1-(2-methoxyacetyl)-2-methyl-5-(3-methyl-2-thienyl)-4-(2-thenoyl)proline Formula: C29H33NO5S2 MolecularWeight: 539.70602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C2C(C(C(N2C(=O)COC)(C)C(=O)O)C3=CC=C(C=C3)C(C)(C)C)C(=O)C4=CC=CS4

Isomeric SMILES

CC1=C(SC=C1)C2C(C(C(N2C(=O)COC)(C)C(=O)O)C3=CC=C(C=C3)C(C)(C)C)C(=O)C4=CC=CS4

InChI

InChI=1S/C29H33NO5S2/c1-17-13-15-37-26(17)24-22(25(32)20-8-7-14-36-20)23(18-9-11-19(12-10-18)28(2,3)4)29(5,27(33)34)30(24)21(31)16-35-6/h7-15,22-24H,16H2,1-6H3,(H,33,34)