N-[(2-piperidin-1-ylsulfonylphenyl)methyl]-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-[(2-piperidin-1-ylsulfonylphenyl)methyl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[[2-(1-piperidylsulfonyl)phenyl]methyl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[[2-(1-piperidinylsulfonyl)phenyl]methyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[(2-piperidin-1-ylsulfonylphenyl)methyl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-(2-piperidinosulfonylbenzyl)piazthiole-4-sulfonamide Formula: C18H20N4O4S3 MolecularWeight: 452.5708

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2CNS(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2CNS(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C18H20N4O4S3/c23-28(24,17-10-6-8-15-18(17)21-27-20-15)19-13-14-7-2-3-9-16(14)29(25,26)22-11-4-1-5-12-22/h2-3,6-10,19H,1,4-5,11-13H2