4-(4-propan-2-ylpiperazin-4-ium-1-yl)sulfonyl-2,1,3-benzothiadiazole

Systemtic Name: 4-(4-propan-2-ylpiperazin-4-ium-1-yl)sulfonyl-2,1,3-benzothiadiazole Openeye Name: 4-(4-isopropylpiperazin-4-ium-1-yl)sulfonyl-2,1,3-benzothiadiazole CAS Name: 4-[(4-propan-2-yl-1-piperazin-4-iumyl)sulfonyl]-2,1,3-benzothiadiazole IUPAC Name: 4-(4-propan-2-ylpiperazin-4-ium-1-yl)sulfonyl-2,1,3-benzothiadiazole Traditional Name: 4-(4-isopropylpiperazin-4-ium-1-yl)sulfonylpiazthiole Formula: C13H19N4O2S2+ MolecularWeight: 327.44556

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CC3=NSN=C32

Isomeric SMILES

CC(C)[NH+]1CCN(CC1)S(=O)(=O)C2=CC=CC3=NSN=C32

InChI

InChI=1S/C13H18N4O2S2/c1-10(2)16-6-8-17(9-7-16)21(18,19)12-5-3-4-11-13(12)15-20-14-11/h3-5,10H,6-9H2,1-2H3/p+1