N4-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine

Systemtic Name: N4-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine Openeye Name: N4-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine CAS Name: N4-[[(3R)-1-methyl-3-piperidin-1-iumyl]methyl]-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine IUPAC Name: 4-N-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]-1H-pyrazolo[3,4-d]pyrimidine-4,6-diamine Traditional Name: (6-amino-1H-pyrazolo[3,4-d]pyrimidin-4-yl)-[[(3R)-1-methylpiperidin-1-ium-3-yl]methyl]amine Formula: C12H20N7+ MolecularWeight: 262.3341

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCCC(C1)CNC2=NC(=NC3=C2C=NN3)N

Isomeric SMILES

C[NH+]1CCC[C@@H](C1)CNC2=NC(=NC3=C2C=NN3)N

InChI

InChI=1S/C12H19N7/c1-19-4-2-3-8(7-19)5-14-10-9-6-15-18-11(9)17-12(13)16-10/h6,8H,2-5,7H2,1H3,(H4,13,14,15,16,17,18)/p+1/t8-/m1/s1