1-methyl-4-piperazin-4-ium-1-yl-6-propan-2-yl-pyrazolo[3,4-d]pyrimidine

Systemtic Name: 1-methyl-4-piperazin-4-ium-1-yl-6-propan-2-yl-pyrazolo[3,4-d]pyrimidine Openeye Name: 6-isopropyl-1-methyl-4-piperazin-4-ium-1-yl-pyrazolo[3,4-d]pyrimidine CAS Name: 1-methyl-4-(1-piperazin-4-iumyl)-6-propan-2-ylpyrazolo[3,4-d]pyrimidine IUPAC Name: 1-methyl-4-piperazin-4-ium-1-yl-6-propan-2-ylpyrazolo[3,4-d]pyrimidine Traditional Name: 6-isopropyl-1-methyl-4-piperazin-4-ium-1-yl-pyrazolo[3,4-d]pyrimidine Formula: C13H21N6+ MolecularWeight: 261.34604

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=C(C=NN2C)C(=N1)N3CC[NH2+]CC3

Isomeric SMILES

CC(C)C1=NC2=C(C=NN2C)C(=N1)N3CC[NH2+]CC3

InChI

InChI=1S/C13H20N6/c1-9(2)11-16-12-10(8-15-18(12)3)13(17-11)19-6-4-14-5-7-19/h8-9,14H,4-7H2,1-3H3/p+1