2,6-dimethoxy-N-[[2-(4-methylpiperazin-1-yl)pyridin-1-ium-3-yl]methyl]pyrimidin-4-amine

Systemtic Name: 2,6-dimethoxy-N-[[2-(4-methylpiperazin-1-yl)pyridin-1-ium-3-yl]methyl]pyrimidin-4-amine Openeye Name: 2,6-dimethoxy-N-[[2-(4-methylpiperazin-1-yl)pyridin-1-ium-3-yl]methyl]pyrimidin-4-amine CAS Name: 2,6-dimethoxy-N-[[2-(4-methyl-1-piperazinyl)-3-pyridin-1-iumyl]methyl]-4-pyrimidinamine IUPAC Name: 2,6-dimethoxy-N-[[2-(4-methylpiperazin-1-yl)pyridin-1-ium-3-yl]methyl]pyrimidin-4-amine Traditional Name: (2,6-dimethoxypyrimidin-4-yl)-[[2-(4-methylpiperazino)pyridin-1-ium-3-yl]methyl]amine Formula: C17H25N6O2+ MolecularWeight: 345.4194

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C2=C(C=CC=[NH+]2)CNC3=CC(=NC(=N3)OC)OC

Isomeric SMILES

CN1CCN(CC1)C2=C(C=CC=[NH+]2)CNC3=CC(=NC(=N3)OC)OC

InChI

InChI=1S/C17H24N6O2/c1-22-7-9-23(10-8-22)16-13(5-4-6-18-16)12-19-14-11-15(24-2)21-17(20-14)25-3/h4-6,11H,7-10,12H2,1-3H3,(H,19,20,21)/p+1