4-bromanyl-7-(4-methylpiperazin-4-ium-1-yl)sulfonyl-2,1,3-benzothiadiazole

Systemtic Name: 4-bromanyl-7-(4-methylpiperazin-4-ium-1-yl)sulfonyl-2,1,3-benzothiadiazole Openeye Name: 4-bromo-7-(4-methylpiperazin-4-ium-1-yl)sulfonyl-2,1,3-benzothiadiazole CAS Name: 4-bromo-7-[(4-methyl-1-piperazin-4-iumyl)sulfonyl]-2,1,3-benzothiadiazole IUPAC Name: 4-bromo-7-(4-methylpiperazin-4-ium-1-yl)sulfonyl-2,1,3-benzothiadiazole Traditional Name: 4-bromo-7-(4-methylpiperazin-4-ium-1-yl)sulfonyl-piazthiole Formula: C11H14BrN4O2S2+ MolecularWeight: 378.28846

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C3=NSN=C23)Br

Isomeric SMILES

C[NH+]1CCN(CC1)S(=O)(=O)C2=CC=C(C3=NSN=C23)Br

InChI

InChI=1S/C11H13BrN4O2S2/c1-15-4-6-16(7-5-15)20(17,18)9-3-2-8(12)10-11(9)14-19-13-10/h2-3H,4-7H2,1H3/p+1