6-methyl-8-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-[1,2,4]triazolo[4,3-b]pyridazine

Systemtic Name: 6-methyl-8-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-[1,2,4]triazolo[4,3-b]pyridazine Openeye Name: 6-methyl-8-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-[1,2,4]triazolo[4,3-b]pyridazine CAS Name: 6-methyl-8-[4-(2-pyridin-1-iumyl)-1-piperazinyl]-[1,2,4]triazolo[4,3-b]pyridazine IUPAC Name: 6-methyl-8-(4-pyridin-1-ium-2-ylpiperazin-1-yl)-[1,2,4]triazolo[4,3-b]pyridazine Traditional Name: 6-methyl-8-(4-pyridin-1-ium-2-ylpiperazino)-[1,2,4]triazolo[4,3-b]pyridazine Formula: C15H18N7+ MolecularWeight: 296.35032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN2C=NN=C2C(=C1)N3CCN(CC3)C4=CC=CC=[NH+]4

Isomeric SMILES

CC1=NN2C=NN=C2C(=C1)N3CCN(CC3)C4=CC=CC=[NH+]4

InChI

InChI=1S/C15H17N7/c1-12-10-13(15-18-17-11-22(15)19-12)20-6-8-21(9-7-20)14-4-2-3-5-16-14/h2-5,10-11H,6-9H2,1H3/p+1