2-azanyl-3-nitrososulfanyl-propanoic acid; ethyl 2-(2-oxidanylidenehydrazinyl)-3-sulfanyl-propanoate

Systemtic Name: 2-azanyl-3-nitrososulfanyl-propanoic acid; ethyl 2-(2-oxidanylidenehydrazinyl)-3-sulfanyl-propanoate Openeye Name: 2-amino-3-nitrososulfanyl-propanoic acid; ethyl 2-(2-oxohydrazino)-3-sulfanyl-propanoate CAS Name: 2-amino-3-(nitrosothio)propanoic acid; 3-mercapto-2-(2-oxohydrazinyl)propanoic acid ethyl ester IUPAC Name: 2-amino-3-nitrososulfanylpropanoic acid; ethyl 2-(2-oxohydrazinyl)-3-sulfanylpropanoate Traditional Name: 2-amino-3-(nitrosothio)propionic acid; 2-(N'-ketohydrazino)-3-mercapto-propionic acid ethyl ester Formula: C8H16N4O6S2 MolecularWeight: 328.36584

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CS)NN=O.C(C(C(=O)O)N)SN=O

Isomeric SMILES

CCOC(=O)C(CS)NN=O.C(C(C(=O)O)N)SN=O

InChI

InChI=1S/C5H10N2O3S.C3H6N2O3S/c1-2-10-5(8)4(3-11)6-7-9;4-2(3(6)7)1-9-5-8/h4,11H,2-3H2,1H3,(H,6,9);2H,1,4H2,(H,6,7)