(4-bromophenyl)-[4-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methanone

Systemtic Name: (4-bromophenyl)-[4-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methanone Openeye Name: (4-bromophenyl)-[4-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methanone CAS Name: (4-bromophenyl)-[4-(1-phenyl-4-pyrazolo[3,4-d]pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: (4-bromophenyl)-[4-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methanone Traditional Name: (4-bromophenyl)-[4-(1-phenylpyrazolo[3,4-d]pyrimidin-4-yl)piperazino]methanone Formula: C22H19BrN6O MolecularWeight: 463.32986

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=NC3=C2C=NN3C4=CC=CC=C4)C(=O)C5=CC=C(C=C5)Br

Isomeric SMILES

C1CN(CCN1C2=NC=NC3=C2C=NN3C4=CC=CC=C4)C(=O)C5=CC=C(C=C5)Br

InChI

InChI=1S/C22H19BrN6O/c23-17-8-6-16(7-9-17)22(30)28-12-10-27(11-13-28)20-19-14-26-29(21(19)25-15-24-20)18-4-2-1-3-5-18/h1-9,14-15H,10-13H2