3-(4-acetamidophenyl)-4-(2,5-dimethylthiophen-3-yl)carbonyl-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-5-(3-methylthiophen-2-yl)-1-thiophen-2-ylcarbonyl-pyrrolidine-2-carboxylic acid Openeye Name: 3-(4-acetamidophenyl)-4-(2,5-dimethylthiophene-3-carbonyl)-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]-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)-5-(3-methylthiophen-2-yl)-1-(thiophene-2-carbonyl)pyrrolidine-2-carboxylic acid Traditional Name: 3-(4-acetamidophenyl)-4-(2,5-dimethylthiophene-3-carbonyl)-5-(3-methyl-2-thienyl)-1-(2-thenoyl)proline Formula: C30H28N2O5S3 MolecularWeight: 592.74872

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C30H28N2O5S3/c1-15-11-13-39-28(15)25-24(27(34)21-14-16(2)40-17(21)3)23(19-7-9-20(10-8-19)31-18(4)33)26(30(36)37)32(25)29(35)22-6-5-12-38-22/h5-14,23-26H,1-4H3,(H,31,33)(H,36,37)