2-(2-azanylidene-2-oxidanidyl-ethyl)-4-ethanoylsulfanyl-3-oxidanylidene-butanoate

Systemtic Name: 2-(2-azanylidene-2-oxidanidyl-ethyl)-4-ethanoylsulfanyl-3-oxidanylidene-butanoate Openeye Name: 4-acetylsulfanyl-2-(2-imino-2-oxido-ethyl)-3-oxo-butanoate CAS Name: 4-(acetylthio)-2-(2-imino-2-oxidoethyl)-3-oxobutanoate IUPAC Name: 4-acetylsulfanyl-2-(2-imino-2-oxidoethyl)-3-oxobutanoate Traditional Name: 4-(acetylthio)-2-(2-imino-2-oxido-ethyl)-3-keto-butyrate Formula: C8H9NO5S-2 MolecularWeight: 231.22576

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC(=O)C(CC(=N)[O-])C(=O)[O-]

Isomeric SMILES

CC(=O)SCC(=O)C(CC(=N)[O-])C(=O)[O-]

InChI

InChI=1S/C8H11NO5S/c1-4(10)15-3-6(11)5(8(13)14)2-7(9)12/h5H,2-3H2,1H3,(H2,9,12)(H,13,14)/p-2