1-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]hexan-1-one

Systemtic Name: 1-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]hexan-1-one Openeye Name: 1-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]hexan-1-one CAS Name: 1-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)-1-piperazinyl]-1-hexanone IUPAC Name: 1-[4-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperazin-1-yl]hexan-1-one Traditional Name: 1-(4-piazthiol-4-ylsulfonylpiperazino)hexan-1-one Formula: C16H22N4O3S2 MolecularWeight: 382.50088

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC3=NSN=C32

Isomeric SMILES

CCCCCC(=O)N1CCN(CC1)S(=O)(=O)C2=CC=CC3=NSN=C32

InChI

InChI=1S/C16H22N4O3S2/c1-2-3-4-8-15(21)19-9-11-20(12-10-19)25(22,23)14-7-5-6-13-16(14)18-24-17-13/h5-7H,2-4,8-12H2,1H3