2,3-bis(sulfanyl)propane-1-sulfonic acid; sodium; hydrate

Systemtic Name: 2,3-bis(sulfanyl)propane-1-sulfonic acid; sodium; hydrate Openeye Name: 2,3-bis(sulfanyl)propane-1-sulfonic acid; sodium; hydrate CAS Name: 2,3-dimercapto-1-propanesulfonic acid; sodium; hydrate IUPAC Name: 2,3-bis(sulfanyl)propane-1-sulfonic acid; sodium; hydrate Traditional Name: 2,3-dimercaptopropane-1-sulfonic acid; sodium; hydrate Formula: C3H10NaO4S3 MolecularWeight: 229.29387

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Descriptors Computed from Structure

Canonical SMILES:

C(C(CS(=O)(=O)O)S)S.O.[Na]

Isomeric SMILES

C(C(CS(=O)(=O)O)S)S.O.[Na]

InChI

InChI=1S/C3H8O3S3.Na.H2O/c4-9(5,6)2-3(8)1-7;;/h3,7-8H,1-2H2,(H,4,5,6);;1H2