N-(2,1,3-benzothiadiazol-4-yl)-2-(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(2,1,3-benzothiadiazol-4-yl)-2-(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(2,1,3-benzothiadiazol-4-yl)-2-[4-(2-naphthylsulfonyl)piperazin-1-ium-1-yl]acetamide CAS Name: N-(2,1,3-benzothiadiazol-4-yl)-2-[4-(2-naphthalenylsulfonyl)-1-piperazin-1-iumyl]acetamide IUPAC Name: N-(2,1,3-benzothiadiazol-4-yl)-2-(4-naphthalen-2-ylsulfonylpiperazin-1-ium-1-yl)acetamide Traditional Name: 2-[4-(2-naphthylsulfonyl)piperazin-1-ium-1-yl]-N-piazthiol-4-yl-acetamide Formula: C22H22N5O3S2+ MolecularWeight: 468.57178

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC(=O)NC2=CC=CC3=NSN=C32)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CN(CC[NH+]1CC(=O)NC2=CC=CC3=NSN=C32)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C22H21N5O3S2/c28-21(23-19-6-3-7-20-22(19)25-31-24-20)15-26-10-12-27(13-11-26)32(29,30)18-9-8-16-4-1-2-5-17(16)14-18/h1-9,14H,10-13,15H2,(H,23,28)/p+1