1-(2-ethanoylsulfanyl-4-oxidanylidene-4-thiophen-2-yl-butanoyl)pyrrolidine-2-carboxylic acid

Systemtic Name: 1-(2-ethanoylsulfanyl-4-oxidanylidene-4-thiophen-2-yl-butanoyl)pyrrolidine-2-carboxylic acid Openeye Name: 1-[2-acetylsulfanyl-4-oxo-4-(2-thienyl)butanoyl]pyrrolidine-2-carboxylic acid CAS Name: 1-[2-(acetylthio)-1,4-dioxo-4-thiophen-2-ylbutyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(2-acetylsulfanyl-4-oxo-4-thiophen-2-ylbutanoyl)pyrrolidine-2-carboxylic acid Traditional Name: 1-[2-(acetylthio)-4-keto-4-(2-thienyl)butanoyl]proline Formula: C15H17NO5S2 MolecularWeight: 355.42918

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC(CC(=O)C1=CC=CS1)C(=O)N2CCCC2C(=O)O

Isomeric SMILES

CC(=O)SC(CC(=O)C1=CC=CS1)C(=O)N2CCCC2C(=O)O

InChI

InChI=1S/C15H17NO5S2/c1-9(17)23-13(8-11(18)12-5-3-7-22-12)14(19)16-6-2-4-10(16)15(20)21/h3,5,7,10,13H,2,4,6,8H2,1H3,(H,20,21)