sodium 3-methylsulfonylsulfanylpropane-1-sulfonate

Systemtic Name: sodium 3-methylsulfonylsulfanylpropane-1-sulfonate Openeye Name: sodium 3-methylsulfonylsulfanylpropane-1-sulfonate CAS Name: sodium 3-(methylsulfonylthio)-1-propanesulfonate IUPAC Name: sodium 3-methylsulfonylsulfanylpropane-1-sulfonate Traditional Name: sodium 3-(mesylthio)propane-1-sulfonate Formula: C4H9NaO5S3 MolecularWeight: 256.29603

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)SCCCS(=O)(=O)[O-].[Na+]

Isomeric SMILES

CS(=O)(=O)SCCCS(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C4H10O5S3.Na/c1-11(5,6)10-3-2-4-12(7,8)9;/h2-4H2,1H3,(H,7,8,9);/q;+1/p-1