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sodium 1-(diethylcarbamothioylsulfanyl)-3-oxidanyl-propane-2-sulfonate

sodium 1-(diethylcarbamothioylsulfanyl)-3-oxidanyl-propane-2-sulfonate

Systemtic Name:sodium 1-(diethylcarbamothioylsulfanyl)-3-oxidanyl-propane-2-sulfonate
Openeye Name:sodium 1-(diethylcarbamothioylsulfanyl)-3-hydroxy-propane-2-sulfonate
CAS Name:sodium 1-[[diethylamino(sulfanylidene)methyl]thio]-3-hydroxy-2-propanesulfonate
IUPAC Name:sodium 1-(diethylcarbamothioylsulfanyl)-3-hydroxypropane-2-sulfonate
Traditional Name:sodium 1-(diethylthiocarbamoylthio)-3-hydroxy-propane-2-sulfonate
Formula: C8H16NNaO4S3
MolecularWeight: 309.40171
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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)SCC(CO)S(=O)(=O)[O-].[Na+]


Isomeric SMILES

CCN(CC)C(=S)SCC(CO)S(=O)(=O)[O-].[Na+]


InChI

InChI=1S/C8H17NO4S3.Na/c1-3-9(4-2)8(14)15-6-7(5-10)16(11,12)13;/h7,10H,3-6H2,1-2H3,(H,11,12,13);/q;+1/p-1


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