3-(ethylcarbamoylsulfanyl)propane-1-sulfonic acid

Systemtic Name: 3-(ethylcarbamoylsulfanyl)propane-1-sulfonic acid Openeye Name: 3-(ethylcarbamoylsulfanyl)propane-1-sulfonic acid CAS Name: 3-(ethylcarbamoylthio)-1-propanesulfonic acid IUPAC Name: 3-(ethylcarbamoylsulfanyl)propane-1-sulfonic acid Traditional Name: 3-(ethylcarbamoylthio)propane-1-sulfonic acid Formula: C6H13NO4S2 MolecularWeight: 227.30172

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)SCCCS(=O)(=O)O

Isomeric SMILES

CCNC(=O)SCCCS(=O)(=O)O

InChI

InChI=1S/C6H13NO4S2/c1-2-7-6(8)12-4-3-5-13(9,10)11/h2-5H2,1H3,(H,7,8)(H,9,10,11)