3-(4-acetamidophenyl)-4-(2,5-dimethylthiophen-3-yl)carbonyl-2-methyl-5-(3-methylthiophen-2-yl)-1-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 3-(4-acetamidophenyl)-4-(2,5-dimethylthiophen-3-yl)carbonyl-2-methyl-5-(3-methylthiophen-2-yl)-1-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxylic acid Openeye Name: 3-(4-acetamidophenyl)-4-(2,5-dimethylthiophene-3-carbonyl)-2-methyl-5-(3-methyl-2-thienyl)-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxylic acid CAS Name: 3-(4-acetamidophenyl)-4-[(2,5-dimethyl-3-thiophenyl)-oxomethyl]-2-methyl-5-(3-methyl-2-thiophenyl)-1-[oxo(thiophen-2-yl)methyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 3-(4-acetamidophenyl)-4-(2,5-dimethylthiophene-3-carbonyl)-2-methyl-5-(3-methylthiophen-2-yl)-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxylic acid Traditional Name: 3-(4-acetamidophenyl)-4-(2,5-dimethylthiophene-3-carbonyl)-2-methyl-5-(3-methyl-2-thienyl)-1-(2-thenoyl)proline Formula: C31H30N2O5S3 MolecularWeight: 606.7753

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C2C(C(C(N2C(=O)C3=CC=CS3)(C)C(=O)O)C4=CC=C(C=C4)NC(=O)C)C(=O)C5=C(SC(=C5)C)C

Isomeric SMILES

CC1=C(SC=C1)C2C(C(C(N2C(=O)C3=CC=CS3)(C)C(=O)O)C4=CC=C(C=C4)NC(=O)C)C(=O)C5=C(SC(=C5)C)C

InChI

InChI=1S/C31H30N2O5S3/c1-16-12-14-40-28(16)26-24(27(35)22-15-17(2)41-18(22)3)25(20-8-10-21(11-9-20)32-19(4)34)31(5,30(37)38)33(26)29(36)23-7-6-13-39-23/h6-15,24-26H,1-5H3,(H,32,34)(H,37,38)