1-[4-[2-carboxy-4-(thiophen-2-ylsulfonylamino)pyrrolidin-1-yl]-4-oxidanylidene-butanoyl]-3-(thiophen-2-ylcarbonylamino)pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[4-[2-carboxy-4-(thiophen-2-ylsulfonylamino)pyrrolidin-1-yl]-4-oxidanylidene-butanoyl]-3-(thiophen-2-ylcarbonylamino)pyrrolidine-2-carboxylic acid Openeye Name: 1-[4-[2-carboxy-4-(2-thienylsulfonylamino)pyrrolidin-1-yl]-4-oxo-butanoyl]-3-(thiophene-2-carbonylamino)pyrrolidine-2-carboxylic acid CAS Name: 1-[4-[2-carboxy-4-(thiophen-2-ylsulfonylamino)-1-pyrrolidinyl]-1,4-dioxobutyl]-3-[[oxo(thiophen-2-yl)methyl]amino]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[4-[2-carboxy-4-(thiophen-2-ylsulfonylamino)pyrrolidin-1-yl]-4-oxobutanoyl]-3-(thiophene-2-carbonylamino)pyrrolidine-2-carboxylic acid Traditional Name: 1-[4-[2-carboxy-4-(2-thienylsulfonylamino)pyrrolidino]-4-keto-butanoyl]-3-(2-thenoylamino)proline Formula: C23H26N4O9S3 MolecularWeight: 598.66894

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C1NC(=O)C2=CC=CS2)C(=O)O)C(=O)CCC(=O)N3CC(CC3C(=O)O)NS(=O)(=O)C4=CC=CS4

Isomeric SMILES

C1CN(C(C1NC(=O)C2=CC=CS2)C(=O)O)C(=O)CCC(=O)N3CC(CC3C(=O)O)NS(=O)(=O)C4=CC=CS4

InChI

InChI=1S/C23H26N4O9S3/c28-17(26-8-7-14(20(26)23(33)34)24-21(30)16-3-1-9-37-16)5-6-18(29)27-12-13(11-15(27)22(31)32)25-39(35,36)19-4-2-10-38-19/h1-4,9-10,13-15,20,25H,5-8,11-12H2,(H,24,30)(H,31,32)(H,33,34)