3-(2-sulfanylideneethanoylamino)propane-1-sulfonic acid

Systemtic Name: 3-(2-sulfanylideneethanoylamino)propane-1-sulfonic acid Openeye Name: 3-[(2-thioxoacetyl)amino]propane-1-sulfonic acid CAS Name: 3-[(1-oxo-2-sulfanylideneethyl)amino]-1-propanesulfonic acid IUPAC Name: 3-[(2-sulfanylideneacetyl)amino]propane-1-sulfonic acid Traditional Name: 3-[(2-thioxoacetyl)amino]propane-1-sulfonic acid Formula: C5H9NO4S2 MolecularWeight: 211.25926

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Descriptors Computed from Structure

Canonical SMILES:

C(CNC(=O)C=S)CS(=O)(=O)O

Isomeric SMILES

C(CNC(=O)C=S)CS(=O)(=O)O

InChI

InChI=1S/C5H9NO4S2/c7-5(4-11)6-2-1-3-12(8,9)10/h4H,1-3H2,(H,6,7)(H,8,9,10)