6-(4-methylpiperazin-4-ium-1-yl)sulfonyl-1,3-benzothiazol-2-amine

Systemtic Name: 6-(4-methylpiperazin-4-ium-1-yl)sulfonyl-1,3-benzothiazol-2-amine Openeye Name: 6-(4-methylpiperazin-4-ium-1-yl)sulfonyl-1,3-benzothiazol-2-amine CAS Name: 6-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]-1,3-benzothiazol-2-amine IUPAC Name: 6-(4-methylpiperazin-4-ium-1-yl)sulfonyl-1,3-benzothiazol-2-amine Traditional Name: [6-(4-methylpiperazin-4-ium-1-yl)sulfonyl-1,3-benzothiazol-2-yl]amine Formula: C12H17N4O2S2+ MolecularWeight: 313.41898

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N=C(S3)N

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC3=C(C=C2)N=C(S3)N

InChI

InChI=1S/C12H16N4O2S2/c1-15-4-6-16(7-5-15)20(17,18)9-2-3-10-11(8-9)19-12(13)14-10/h2-3,8H,4-7H2,1H3,(H2,13,14)/p+1