N-[2-oxidanylidene-1-phenyl-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-[2-oxidanylidene-1-phenyl-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[2-oxo-1-phenyl-2-[4-(2-pyridyl)piperazin-1-yl]ethyl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[2-oxo-1-phenyl-2-[4-(2-pyridinyl)-1-piperazinyl]ethyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[2-oxo-1-phenyl-2-(4-pyridin-2-ylpiperazin-1-yl)ethyl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[2-keto-1-phenyl-2-[4-(2-pyridyl)piperazino]ethyl]piazthiole-4-sulfonamide Formula: C23H22N6O3S2 MolecularWeight: 494.58918

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)C(=O)C(C3=CC=CC=C3)NS(=O)(=O)C4=CC=CC5=NSN=C54

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)C(=O)C(C3=CC=CC=C3)NS(=O)(=O)C4=CC=CC5=NSN=C54

InChI

InChI=1S/C23H22N6O3S2/c30-23(29-15-13-28(14-16-29)20-11-4-5-12-24-20)21(17-7-2-1-3-8-17)27-34(31,32)19-10-6-9-18-22(19)26-33-25-18/h1-12,21,27H,13-16H2