2-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-ium-1-yl]ethanamide

Systemtic Name: 2-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-ium-1-yl]ethanamide Openeye Name: 2-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-ium-1-yl]acetamide CAS Name: 2-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: 2-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-ium-1-yl]acetamide Traditional Name: 2-(4-piazthiol-4-ylsulfonylpiperazin-1-ium-1-yl)acetamide Formula: C12H16N5O3S2+ MolecularWeight: 342.41714

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)N)S(=O)(=O)C2=CC=CC3=NSN=C32

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)N)S(=O)(=O)C2=CC=CC3=NSN=C32

InChI

InChI=1S/C12H15N5O3S2/c13-11(18)8-16-4-6-17(7-5-16)22(19,20)10-3-1-2-9-12(10)15-21-14-9/h1-3H,4-8H2,(H2,13,18)/p+1