2-[[2-sulfanylidene-2-(2-sulfoethylamino)ethanoyl]amino]ethanesulfonic acid

Systemtic Name: 2-[[2-sulfanylidene-2-(2-sulfoethylamino)ethanoyl]amino]ethanesulfonic acid Openeye Name: 2-[[2-(2-sulfoethylamino)-2-thioxo-acetyl]amino]ethanesulfonic acid CAS Name: 2-[[1-oxo-2-sulfanylidene-2-(2-sulfoethylamino)ethyl]amino]ethanesulfonic acid IUPAC Name: 2-[[2-sulfanylidene-2-(2-sulfoethylamino)acetyl]amino]ethanesulfonic acid Traditional Name: 2-[[2-(2-sulfoethylamino)-2-thioxo-acetyl]amino]ethanesulfonic acid Formula: C6H12N2O7S3 MolecularWeight: 320.36368

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C(CS(=O)(=O)O)NC(=O)C(=S)NCCS(=O)(=O)O

Isomeric SMILES

C(CS(=O)(=O)O)NC(=O)C(=S)NCCS(=O)(=O)O

InChI

InChI=1S/C6H12N2O7S3/c9-5(7-1-3-17(10,11)12)6(16)8-2-4-18(13,14)15/h1-4H2,(H,7,9)(H,8,16)(H,10,11,12)(H,13,14,15)