3-(2-methylsulfanyl-3-sulfanyl-propanoyl)-6,9-bis(oxidanylidene)-3-azaspiro[4.4]nonane-2-carboxylic acid

Systemtic Name: 3-(2-methylsulfanyl-3-sulfanyl-propanoyl)-6,9-bis(oxidanylidene)-3-azaspiro[4.4]nonane-2-carboxylic acid Openeye Name: 3-(2-methylsulfanyl-3-sulfanyl-propanoyl)-6,9-dioxo-3-azaspiro[4.4]nonane-2-carboxylic acid CAS Name: 3-[3-mercapto-2-(methylthio)-1-oxopropyl]-6,9-dioxo-3-azaspiro[4.4]nonane-2-carboxylic acid IUPAC Name: 3-(2-methylsulfanyl-3-sulfanylpropanoyl)-6,9-dioxo-3-azaspiro[4.4]nonane-2-carboxylic acid Traditional Name: 6,9-diketo-3-[3-mercapto-2-(methylthio)propanoyl]-3-azaspiro[4.4]nonane-2-carboxylic acid Formula: C13H17NO5S2 MolecularWeight: 331.40778

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Descriptors Computed from Structure

Canonical SMILES:

CSC(CS)C(=O)N1CC2(CC1C(=O)O)C(=O)CCC2=O

Isomeric SMILES

CSC(CS)C(=O)N1CC2(CC1C(=O)O)C(=O)CCC2=O

InChI

InChI=1S/C13H17NO5S2/c1-21-8(5-20)11(17)14-6-13(4-7(14)12(18)19)9(15)2-3-10(13)16/h7-8,20H,2-6H2,1H3,(H,18,19)