3-bromanyl-4-[4-(pyridin-4-ylmethyl)piperazin-1-yl]-2H-pyrazolo[3,4-d]pyrimidine

Systemtic Name: 3-bromanyl-4-[4-(pyridin-4-ylmethyl)piperazin-1-yl]-2H-pyrazolo[3,4-d]pyrimidine Openeye Name: 3-bromo-4-[4-(4-pyridylmethyl)piperazin-1-yl]-2H-pyrazolo[3,4-d]pyrimidine CAS Name: 3-bromo-4-[4-(pyridin-4-ylmethyl)-1-piperazinyl]-2H-pyrazolo[3,4-d]pyrimidine IUPAC Name: 3-bromo-4-[4-(pyridin-4-ylmethyl)piperazin-1-yl]-2H-pyrazolo[3,4-d]pyrimidine Traditional Name: 3-bromo-4-[4-(4-pyridylmethyl)piperazino]-2H-pyrazolo[3,4-d]pyrimidine Formula: C15H16BrN7 MolecularWeight: 374.23844

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=NC=C2)C3=NC=NC4=NNC(=C43)Br

Isomeric SMILES

C1CN(CCN1CC2=CC=NC=C2)C3=NC=NC4=NNC(=C43)Br

InChI

InChI=1S/C15H16BrN7/c16-13-12-14(21-20-13)18-10-19-15(12)23-7-5-22(6-8-23)9-11-1-3-17-4-2-11/h1-4,10H,5-9H2,(H,18,19,20,21)