sodium 3-ethylsulfanylcarbothioylsulfanylpropane-1-sulfonate

Systemtic Name: sodium 3-ethylsulfanylcarbothioylsulfanylpropane-1-sulfonate Openeye Name: sodium 3-ethylsulfanylcarbothioylsulfanylpropane-1-sulfonate CAS Name: sodium 3-[[(ethylthio)-sulfanylidenemethyl]thio]-1-propanesulfonate IUPAC Name: sodium 3-ethylsulfanylcarbothioylsulfanylpropane-1-sulfonate Traditional Name: sodium 3-[(ethylthio)carbothioylthio]propane-1-sulfonate Formula: C6H11NaO3S4 MolecularWeight: 282.39951

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(=S)SCCCS(=O)(=O)[O-].[Na+]

Isomeric SMILES

CCSC(=S)SCCCS(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C6H12O3S4.Na/c1-2-11-6(10)12-4-3-5-13(7,8)9;/h2-5H2,1H3,(H,7,8,9);/q;+1/p-1