6-ethyl-1-methyl-4-piperazin-4-ium-1-yl-pyrazolo[3,4-d]pyrimidine

Systemtic Name: 6-ethyl-1-methyl-4-piperazin-4-ium-1-yl-pyrazolo[3,4-d]pyrimidine Openeye Name: 6-ethyl-1-methyl-4-piperazin-4-ium-1-yl-pyrazolo[3,4-d]pyrimidine CAS Name: 6-ethyl-1-methyl-4-(1-piperazin-4-iumyl)pyrazolo[3,4-d]pyrimidine IUPAC Name: 6-ethyl-1-methyl-4-piperazin-4-ium-1-ylpyrazolo[3,4-d]pyrimidine Traditional Name: 6-ethyl-1-methyl-4-piperazin-4-ium-1-yl-pyrazolo[3,4-d]pyrimidine Formula: C12H19N6+ MolecularWeight: 247.31946

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C=NN2C)C(=N1)N3CC[NH2+]CC3

Isomeric SMILES

CCC1=NC2=C(C=NN2C)C(=N1)N3CC[NH2+]CC3

InChI

InChI=1S/C12H18N6/c1-3-10-15-11-9(8-14-17(11)2)12(16-10)18-6-4-13-5-7-18/h8,13H,3-7H2,1-2H3/p+1