2-methylsulfanyl-4,5-dihydro-1H-imidazol-3-ium sulfate

Systemtic Name: 2-methylsulfanyl-4,5-dihydro-1H-imidazol-3-ium sulfate Openeye Name: 2-methylsulfanyl-4,5-dihydro-1H-imidazol-3-ium sulfate CAS Name: 2-(methylthio)-4,5-dihydro-1H-imidazol-3-ium sulfate IUPAC Name: 2-methylsulfanyl-4,5-dihydro-1H-imidazol-3-ium sulfate Traditional Name: 2-(methylthio)-2-imidazolin-1-ium sulfate Formula: C8H18N4O4S3 MolecularWeight: 330.44792

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=[NH+]CCN1.CSC1=[NH+]CCN1.[O-]S(=O)(=O)[O-]

Isomeric SMILES

CSC1=[NH+]CCN1.CSC1=[NH+]CCN1.[O-]S(=O)(=O)[O-]

InChI

InChI=1S/2C4H8N2S.H2O4S/c2*1-7-4-5-2-3-6-4;1-5(2,3)4/h2*2-3H2,1H3,(H,5,6);(H2,1,2,3,4)