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

Systemtic Name: 1-[4-[2-carboxy-4-(furan-2-ylcarbonylamino)pyrrolidin-1-yl]-4-oxidanylidene-butanoyl]-3-(thiophen-2-ylcarbonylamino)pyrrolidine-2-carboxylic acid Openeye Name: 1-[4-[2-carboxy-4-(furan-2-carbonylamino)pyrrolidin-1-yl]-4-oxo-butanoyl]-3-(thiophene-2-carbonylamino)pyrrolidine-2-carboxylic acid CAS Name: 1-[4-[2-carboxy-4-[[2-furanyl(oxo)methyl]amino]-1-pyrrolidinyl]-1,4-dioxobutyl]-3-[[oxo(thiophen-2-yl)methyl]amino]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[4-[2-carboxy-4-(furan-2-carbonylamino)pyrrolidin-1-yl]-4-oxobutanoyl]-3-(thiophene-2-carbonylamino)pyrrolidine-2-carboxylic acid Traditional Name: 1-[4-[2-carboxy-4-(2-furoylamino)pyrrolidino]-4-keto-butanoyl]-3-(2-thenoylamino)proline Formula: C24H26N4O9S MolecularWeight: 546.54964

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(C1NC(=O)C2=CC=CS2)C(=O)O)C(=O)CCC(=O)N3CC(CC3C(=O)O)NC(=O)C4=CC=CO4

Isomeric SMILES

C1CN(C(C1NC(=O)C2=CC=CS2)C(=O)O)C(=O)CCC(=O)N3CC(CC3C(=O)O)NC(=O)C4=CC=CO4

InChI

InChI=1S/C24H26N4O9S/c29-18(27-8-7-14(20(27)24(35)36)26-22(32)17-4-2-10-38-17)5-6-19(30)28-12-13(11-15(28)23(33)34)25-21(31)16-3-1-9-37-16/h1-4,9-10,13-15,20H,5-8,11-12H2,(H,25,31)(H,26,32)(H,33,34)(H,35,36)