sodium 3-(dimethylcarbamothioylsulfanyl)propane-1-sulfonate

Systemtic Name: sodium 3-(dimethylcarbamothioylsulfanyl)propane-1-sulfonate Openeye Name: sodium 3-(dimethylcarbamothioylsulfanyl)propane-1-sulfonate CAS Name: sodium 3-[[dimethylamino(sulfanylidene)methyl]thio]-1-propanesulfonate IUPAC Name: sodium 3-(dimethylcarbamothioylsulfanyl)propane-1-sulfonate Traditional Name: sodium 3-(dimethylthiocarbamoylthio)propane-1-sulfonate Formula: C6H12NNaO3S3 MolecularWeight: 265.34915

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H13NO3S3.Na/c1-7(2)6(11)12-4-3-5-13(8,9)10;/h3-5H2,1-2H3,(H,8,9,10);/q;+1/p-1