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

Systemtic Name: 3-bromanyl-4-[4-[(4-bromophenyl)methyl]piperazin-1-yl]-2H-pyrazolo[3,4-d]pyrimidine Openeye Name: 3-bromo-4-[4-[(4-bromophenyl)methyl]piperazin-1-yl]-2H-pyrazolo[3,4-d]pyrimidine CAS Name: 3-bromo-4-[4-[(4-bromophenyl)methyl]-1-piperazinyl]-2H-pyrazolo[3,4-d]pyrimidine IUPAC Name: 3-bromo-4-[4-[(4-bromophenyl)methyl]piperazin-1-yl]-2H-pyrazolo[3,4-d]pyrimidine Traditional Name: 3-bromo-4-[4-(4-bromobenzyl)piperazino]-2H-pyrazolo[3,4-d]pyrimidine Formula: C16H16Br2N6 MolecularWeight: 452.14644

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H16Br2N6/c17-12-3-1-11(2-4-12)9-23-5-7-24(8-6-23)16-13-14(18)21-22-15(13)19-10-20-16/h1-4,10H,5-9H2,(H,19,20,21,22)