N-[1-(phenylmethyl)piperidin-1-ium-4-yl]-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-[1-(phenylmethyl)piperidin-1-ium-4-yl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-(1-benzylpiperidin-1-ium-4-yl)-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[1-(phenylmethyl)-4-piperidin-1-iumyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-(1-benzylpiperidin-1-ium-4-yl)-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-(1-benzylpiperidin-1-ium-4-yl)piazthiole-4-sulfonamide Formula: C18H21N4O2S2+ MolecularWeight: 389.51494

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NS(=O)(=O)C2=CC=CC3=NSN=C32)CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1NS(=O)(=O)C2=CC=CC3=NSN=C32)CC4=CC=CC=C4

InChI

InChI=1S/C18H20N4O2S2/c23-26(24,17-8-4-7-16-18(17)20-25-19-16)21-15-9-11-22(12-10-15)13-14-5-2-1-3-6-14/h1-8,15,21H,9-13H2/p+1