1-[2-[[1-oxidanyl-1,5-bis(oxidanylidene)-5-thiophen-2-yl-pentan-2-yl]amino]propanoyl]pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[2-[[1-oxidanyl-1,5-bis(oxidanylidene)-5-thiophen-2-yl-pentan-2-yl]amino]propanoyl]pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-[[1-carboxy-4-oxo-4-(2-thienyl)butyl]amino]propanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-[(1-hydroxy-1,5-dioxo-5-thiophen-2-ylpentan-2-yl)amino]-1-oxopropyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[2-[(1-hydroxy-1,5-dioxo-5-thiophen-2-ylpentan-2-yl)amino]propanoyl]pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-[[1-carboxy-4-keto-4-(2-thienyl)butyl]amino]propanoyl]proline Formula: C17H22N2O6S MolecularWeight: 382.43138

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)N1CCCC1C(=O)O)NC(CCC(=O)C2=CC=CS2)C(=O)O

Isomeric SMILES

CC(C(=O)N1CCCC1C(=O)O)NC(CCC(=O)C2=CC=CS2)C(=O)O

InChI

InChI=1S/C17H22N2O6S/c1-10(15(21)19-8-2-4-12(19)17(24)25)18-11(16(22)23)6-7-13(20)14-5-3-9-26-14/h3,5,9-12,18H,2,4,6-8H2,1H3,(H,22,23)(H,24,25)