4,6-dimethyl-N-[[2-[methyl(2-pyridin-2-ylethyl)amino]pyridin-1-ium-3-yl]methyl]pyrimidin-2-amine

Systemtic Name: 4,6-dimethyl-N-[[2-[methyl(2-pyridin-2-ylethyl)amino]pyridin-1-ium-3-yl]methyl]pyrimidin-2-amine Openeye Name: 4,6-dimethyl-N-[[2-[methyl-[2-(2-pyridyl)ethyl]amino]pyridin-1-ium-3-yl]methyl]pyrimidin-2-amine CAS Name: 4,6-dimethyl-N-[[2-[methyl-[2-(2-pyridinyl)ethyl]amino]-3-pyridin-1-iumyl]methyl]-2-pyrimidinamine IUPAC Name: 4,6-dimethyl-N-[[2-[methyl(2-pyridin-2-ylethyl)amino]pyridin-1-ium-3-yl]methyl]pyrimidin-2-amine Traditional Name: [3-[[(4,6-dimethylpyrimidin-2-yl)amino]methyl]pyridin-1-ium-2-yl]-methyl-[2-(2-pyridyl)ethyl]amine Formula: C20H25N6+ MolecularWeight: 349.4527

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)NCC2=C([NH+]=CC=C2)N(C)CCC3=CC=CC=N3)C

Isomeric SMILES

CC1=CC(=NC(=N1)NCC2=C([NH+]=CC=C2)N(C)CCC3=CC=CC=N3)C

InChI

InChI=1S/C20H24N6/c1-15-13-16(2)25-20(24-15)23-14-17-7-6-11-22-19(17)26(3)12-9-18-8-4-5-10-21-18/h4-8,10-11,13H,9,12,14H2,1-3H3,(H,23,24,25)/p+1