3-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-6-(4-methylpiperazin-4-ium-1-yl)pyridazine

Systemtic Name: 3-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-6-(4-methylpiperazin-4-ium-1-yl)pyridazine Openeye Name: 3-(4-methylpiperazin-4-ium-1-yl)-6-[4-(p-tolylsulfonyl)piperazin-1-yl]pyridazine CAS Name: 3-[4-(4-methylphenyl)sulfonyl-1-piperazinyl]-6-(4-methyl-1-piperazin-4-iumyl)pyridazine IUPAC Name: 3-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-6-(4-methylpiperazin-4-ium-1-yl)pyridazine Traditional Name: 3-(4-methylpiperazin-4-ium-1-yl)-6-(4-tosylpiperazino)pyridazine Formula: C20H29N6O2S+ MolecularWeight: 417.54826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NN=C(C=C3)N4CC[NH+](CC4)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=NN=C(C=C3)N4CC[NH+](CC4)C

InChI

InChI=1S/C20H28N6O2S/c1-17-3-5-18(6-4-17)29(27,28)26-15-13-25(14-16-26)20-8-7-19(21-22-20)24-11-9-23(2)10-12-24/h3-8H,9-16H2,1-2H3/p+1