4-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-2,1,3-benzothiadiazole

Systemtic Name: 4-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-2,1,3-benzothiadiazole Openeye Name: 4-(4-benzylpiperazin-1-yl)sulfonyl-2,1,3-benzothiadiazole CAS Name: 4-[[4-(phenylmethyl)-1-piperazinyl]sulfonyl]-2,1,3-benzothiadiazole IUPAC Name: 4-(4-benzylpiperazin-1-yl)sulfonyl-2,1,3-benzothiadiazole Traditional Name: 4-(4-benzylpiperazino)sulfonylpiazthiole Formula: C17H18N4O2S2 MolecularWeight: 374.48042

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)S(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)S(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C17H18N4O2S2/c22-25(23,16-8-4-7-15-17(16)19-24-18-15)21-11-9-20(10-12-21)13-14-5-2-1-3-6-14/h1-8H,9-13H2