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

Systemtic Name: N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[1-[(4-chlorophenyl)methyl]-4-piperidin-1-iumyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[1-[(4-chlorophenyl)methyl]piperidin-1-ium-4-yl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[1-(4-chlorobenzyl)piperidin-1-ium-4-yl]piazthiole-4-sulfonamide Formula: C18H20ClN4O2S2+ MolecularWeight: 423.96

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H19ClN4O2S2/c19-14-6-4-13(5-7-14)12-23-10-8-15(9-11-23)22-27(24,25)17-3-1-2-16-18(17)21-26-20-16/h1-7,15,22H,8-12H2/p+1