1-phenyl-4-piperazin-4-ium-1-yl-pyrazolo[3,4-d]pyrimidine

Systemtic Name: 1-phenyl-4-piperazin-4-ium-1-yl-pyrazolo[3,4-d]pyrimidine Openeye Name: 1-phenyl-4-piperazin-4-ium-1-yl-pyrazolo[3,4-d]pyrimidine CAS Name: 1-phenyl-4-(1-piperazin-4-iumyl)pyrazolo[3,4-d]pyrimidine IUPAC Name: 1-phenyl-4-piperazin-4-ium-1-ylpyrazolo[3,4-d]pyrimidine Traditional Name: 1-phenyl-4-piperazin-4-ium-1-yl-pyrazolo[3,4-d]pyrimidine Formula: C15H17N6+ MolecularWeight: 281.33568

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH2+]1)C2=NC=NC3=C2C=NN3C4=CC=CC=C4

Isomeric SMILES

C1CN(CC[NH2+]1)C2=NC=NC3=C2C=NN3C4=CC=CC=C4

InChI

InChI=1S/C15H16N6/c1-2-4-12(5-3-1)21-15-13(10-19-21)14(17-11-18-15)20-8-6-16-7-9-20/h1-5,10-11,16H,6-9H2/p+1