2-(diethylcarbamothioylsulfanyl)ethanesulfonic acid

Systemtic Name: 2-(diethylcarbamothioylsulfanyl)ethanesulfonic acid Openeye Name: 2-(diethylcarbamothioylsulfanyl)ethanesulfonic acid CAS Name: 2-[[diethylamino(sulfanylidene)methyl]thio]ethanesulfonic acid IUPAC Name: 2-(diethylcarbamothioylsulfanyl)ethanesulfonic acid Traditional Name: 2-(diethylthiocarbamoylthio)ethanesulfonic acid Formula: C7H15NO3S3 MolecularWeight: 257.3939

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=S)SCCS(=O)(=O)O

Isomeric SMILES

CCN(CC)C(=S)SCCS(=O)(=O)O

InChI

InChI=1S/C7H15NO3S3/c1-3-8(4-2)7(12)13-5-6-14(9,10)11/h3-6H2,1-2H3,(H,9,10,11)