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

Systemtic Name: 3-bromanyl-4-[4-(1-phenylethyl)piperazin-1-yl]-2H-pyrazolo[3,4-d]pyrimidine Openeye Name: 3-bromo-4-[4-(1-phenylethyl)piperazin-1-yl]-2H-pyrazolo[3,4-d]pyrimidine CAS Name: 3-bromo-4-[4-(1-phenylethyl)-1-piperazinyl]-2H-pyrazolo[3,4-d]pyrimidine IUPAC Name: 3-bromo-4-[4-(1-phenylethyl)piperazin-1-yl]-2H-pyrazolo[3,4-d]pyrimidine Traditional Name: 3-bromo-4-[4-(1-phenylethyl)piperazino]-2H-pyrazolo[3,4-d]pyrimidine Formula: C17H19BrN6 MolecularWeight: 387.27696

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)N2CCN(CC2)C3=NC=NC4=NNC(=C43)Br

Isomeric SMILES

CC(C1=CC=CC=C1)N2CCN(CC2)C3=NC=NC4=NNC(=C43)Br

InChI

InChI=1S/C17H19BrN6/c1-12(13-5-3-2-4-6-13)23-7-9-24(10-8-23)17-14-15(18)21-22-16(14)19-11-20-17/h2-6,11-12H,7-10H2,1H3,(H,19,20,21,22)