2-[4-(4-phenylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidin-1-yl]ethylazanium

Systemtic Name: 2-[4-(4-phenylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidin-1-yl]ethylazanium Openeye Name: 2-[4-(4-phenylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidin-1-yl]ethylammonium CAS Name: 2-[4-(4-phenyl-1-piperazinyl)-1-pyrazolo[3,4-d]pyrimidinyl]ethylammonium IUPAC Name: 2-[4-(4-phenylpiperazin-1-yl)pyrazolo[3,4-d]pyrimidin-1-yl]ethylazanium Traditional Name: 2-[4-(4-phenylpiperazino)pyrazolo[3,4-d]pyrimidin-1-yl]ethylammonium Formula: C17H22N7+ MolecularWeight: 324.40348

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C3=NC=NC4=C3C=NN4CC[NH3+]

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C3=NC=NC4=C3C=NN4CC[NH3+]

InChI

InChI=1S/C17H21N7/c18-6-7-24-17-15(12-21-24)16(19-13-20-17)23-10-8-22(9-11-23)14-4-2-1-3-5-14/h1-5,12-13H,6-11,18H2/p+1