diazanium 3-ethyl-2H-1,3-benzothiazole sulfate

Systemtic Name: diazanium 3-ethyl-2H-1,3-benzothiazole sulfate Openeye Name: diammonium 3-ethyl-2H-1,3-benzothiazole sulfate CAS Name: diammonium 3-ethyl-2H-1,3-benzothiazole sulfate IUPAC Name: diazanium 3-ethyl-2H-1,3-benzothiazole sulfate Traditional Name: diammonium 3-ethyl-2H-1,3-benzothiazole sulfate Formula: C9H19N3O4S2 MolecularWeight: 297.39486

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CSC2=CC=CC=C21.[NH4+].[NH4+].[O-]S(=O)(=O)[O-]

Isomeric SMILES

CCN1CSC2=CC=CC=C21.[NH4+].[NH4+].[O-]S(=O)(=O)[O-]

InChI

InChI=1S/C9H11NS.2H3N.H2O4S/c1-2-10-7-11-9-6-4-3-5-8(9)10;;;1-5(2,3)4/h3-6H,2,7H2,1H3;2*1H3;(H2,1,2,3,4)