3-(diethylcarbamothioylsulfanyl)propanoic acid

Systemtic Name: 3-(diethylcarbamothioylsulfanyl)propanoic acid Openeye Name: 3-(diethylcarbamothioylsulfanyl)propanoic acid CAS Name: 3-[[diethylamino(sulfanylidene)methyl]thio]propanoic acid IUPAC Name: 3-(diethylcarbamothioylsulfanyl)propanoic acid Traditional Name: 3-(diethylthiocarbamoylthio)propionic acid Formula: C8H15NO2S2 MolecularWeight: 221.3402

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H15NO2S2/c1-3-9(4-2)8(12)13-6-5-7(10)11/h3-6H2,1-2H3,(H,10,11)