6-methylsulfonyl-1,3-benzothiazol-3-ium-2-amine

Systemtic Name: 6-methylsulfonyl-1,3-benzothiazol-3-ium-2-amine Openeye Name: 6-methylsulfonyl-1,3-benzothiazol-3-ium-2-amine CAS Name: 6-methylsulfonyl-1,3-benzothiazol-3-ium-2-amine IUPAC Name: 6-methylsulfonyl-1,3-benzothiazol-3-ium-2-amine Traditional Name: (6-mesyl-1,3-benzothiazol-3-ium-2-yl)amine Formula: C8H9N2O2S2+ MolecularWeight: 229.29926

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC2=C(C=C1)[NH+]=C(S2)N

Isomeric SMILES

CS(=O)(=O)C1=CC2=C(C=C1)[NH+]=C(S2)N

InChI

InChI=1S/C8H8N2O2S2/c1-14(11,12)5-2-3-6-7(4-5)13-8(9)10-6/h2-4H,1H3,(H2,9,10)/p+1