1-methyl-4-(4-methylpiperazin-4-ium-1-yl)pyrazolo[3,4-d]pyrimidin-3-amine

Systemtic Name: 1-methyl-4-(4-methylpiperazin-4-ium-1-yl)pyrazolo[3,4-d]pyrimidin-3-amine Openeye Name: 1-methyl-4-(4-methylpiperazin-4-ium-1-yl)pyrazolo[3,4-d]pyrimidin-3-amine CAS Name: 1-methyl-4-(4-methyl-1-piperazin-4-iumyl)-3-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 1-methyl-4-(4-methylpiperazin-4-ium-1-yl)pyrazolo[3,4-d]pyrimidin-3-amine Traditional Name: [1-methyl-4-(4-methylpiperazin-4-ium-1-yl)pyrazolo[3,4-d]pyrimidin-3-yl]amine Formula: C11H18N7+ MolecularWeight: 248.30752

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=NC=NC3=C2C(=NN3C)N

Isomeric SMILES

C[NH+]1CCN(CC1)C2=NC=NC3=C2C(=NN3C)N

InChI

InChI=1S/C11H17N7/c1-16-3-5-18(6-4-16)11-8-9(12)15-17(2)10(8)13-7-14-11/h7H,3-6H2,1-2H3,(H2,12,15)/p+1