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

Systemtic Name: N-[2-fluoranyl-3-oxidanylidene-3-(4-pyridin-4-ylpiperazin-1-yl)propyl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[2-fluoro-3-oxo-3-[4-(4-pyridyl)piperazin-1-yl]propyl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[2-fluoro-3-oxo-3-(4-pyridin-4-yl-1-piperazinyl)propyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[2-fluoro-3-oxo-3-(4-pyridin-4-ylpiperazin-1-yl)propyl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[2-fluoro-3-keto-3-[4-(4-pyridyl)piperazino]propyl]piazthiole-4-sulfonamide Formula: C18H19FN6O3S2 MolecularWeight: 450.510263

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=NC=C2)C(=O)C(CNS(=O)(=O)C3=CC=CC4=NSN=C43)F

Isomeric SMILES

C1CN(CCN1C2=CC=NC=C2)C(=O)C(CNS(=O)(=O)C3=CC=CC4=NSN=C43)F

InChI

InChI=1S/C18H19FN6O3S2/c19-14(12-21-30(27,28)16-3-1-2-15-17(16)23-29-22-15)18(26)25-10-8-24(9-11-25)13-4-6-20-7-5-13/h1-7,14,21H,8-12H2