1-(4,6-dimethylpyrimidin-2-yl)-4-piperazin-4-ium-1-yl-pyrazolo[3,4-d]pyrimidine

Systemtic Name: 1-(4,6-dimethylpyrimidin-2-yl)-4-piperazin-4-ium-1-yl-pyrazolo[3,4-d]pyrimidine Openeye Name: 1-(4,6-dimethylpyrimidin-2-yl)-4-piperazin-4-ium-1-yl-pyrazolo[3,4-d]pyrimidine CAS Name: 1-(4,6-dimethyl-2-pyrimidinyl)-4-(1-piperazin-4-iumyl)pyrazolo[3,4-d]pyrimidine IUPAC Name: 1-(4,6-dimethylpyrimidin-2-yl)-4-piperazin-4-ium-1-ylpyrazolo[3,4-d]pyrimidine Traditional Name: 1-(4,6-dimethylpyrimidin-2-yl)-4-piperazin-4-ium-1-yl-pyrazolo[3,4-d]pyrimidine Formula: C15H19N8+ MolecularWeight: 311.36496

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)N2C3=C(C=N2)C(=NC=N3)N4CC[NH2+]CC4)C

Isomeric SMILES

CC1=CC(=NC(=N1)N2C3=C(C=N2)C(=NC=N3)N4CC[NH2+]CC4)C

InChI

InChI=1S/C15H18N8/c1-10-7-11(2)21-15(20-10)23-14-12(8-19-23)13(17-9-18-14)22-5-3-16-4-6-22/h7-9,16H,3-6H2,1-2H3/p+1