4-[4-(diphenylmethyl)piperazin-4-ium-1-yl]sulfonyl-2,1,3-benzothiadiazole

Systemtic Name: 4-[4-(diphenylmethyl)piperazin-4-ium-1-yl]sulfonyl-2,1,3-benzothiadiazole Openeye Name: 4-(4-benzhydrylpiperazin-4-ium-1-yl)sulfonyl-2,1,3-benzothiadiazole CAS Name: 4-[[4-(diphenylmethyl)-1-piperazin-4-iumyl]sulfonyl]-2,1,3-benzothiadiazole IUPAC Name: 4-(4-benzhydrylpiperazin-4-ium-1-yl)sulfonyl-2,1,3-benzothiadiazole Traditional Name: 4-(4-benzhydrylpiperazin-4-ium-1-yl)sulfonylpiazthiole Formula: C23H23N4O2S2+ MolecularWeight: 451.58432

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC5=NSN=C54

Isomeric SMILES

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)S(=O)(=O)C4=CC=CC5=NSN=C54

InChI

InChI=1S/C23H22N4O2S2/c28-31(29,21-13-7-12-20-22(21)25-30-24-20)27-16-14-26(15-17-27)23(18-8-3-1-4-9-18)19-10-5-2-6-11-19/h1-13,23H,14-17H2/p+1