3-(2,1,3-benzothiadiazol-4-ylsulfonyl)-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-(2,1,3-benzothiadiazol-4-ylsulfonyl)-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one Openeye Name: 3-(2,1,3-benzothiadiazol-4-ylsulfonyl)-1-[4-(2-pyridyl)piperazin-1-yl]propan-1-one CAS Name: 3-(2,1,3-benzothiadiazol-4-ylsulfonyl)-1-[4-(2-pyridinyl)-1-piperazinyl]-1-propanone IUPAC Name: 3-(2,1,3-benzothiadiazol-4-ylsulfonyl)-1-(4-pyridin-2-ylpiperazin-1-yl)propan-1-one Traditional Name: 3-piazthiol-4-ylsulfonyl-1-[4-(2-pyridyl)piperazino]propan-1-one Formula: C18H19N5O3S2 MolecularWeight: 417.50516

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=N2)C(=O)CCS(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

C1CN(CCN1C2=CC=CC=N2)C(=O)CCS(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C18H19N5O3S2/c24-17(23-11-9-22(10-12-23)16-6-1-2-8-19-16)7-13-28(25,26)15-5-3-4-14-18(15)21-27-20-14/h1-6,8H,7,9-13H2