4-(3-bromanyl-2H-pyrazolo[3,4-d]pyrimidin-4-yl)-1-[(4-chlorophenyl)methyl]piperazin-2-one

Systemtic Name: 4-(3-bromanyl-2H-pyrazolo[3,4-d]pyrimidin-4-yl)-1-[(4-chlorophenyl)methyl]piperazin-2-one Openeye Name: 4-(3-bromo-2H-pyrazolo[3,4-d]pyrimidin-4-yl)-1-[(4-chlorophenyl)methyl]piperazin-2-one CAS Name: 4-(3-bromo-2H-pyrazolo[3,4-d]pyrimidin-4-yl)-1-[(4-chlorophenyl)methyl]-2-piperazinone IUPAC Name: 4-(3-bromo-2H-pyrazolo[3,4-d]pyrimidin-4-yl)-1-[(4-chlorophenyl)methyl]piperazin-2-one Traditional Name: 4-(3-bromo-2H-pyrazolo[3,4-d]pyrimidin-4-yl)-1-(4-chlorobenzyl)piperazin-2-one Formula: C16H14BrClN6O MolecularWeight: 421.67896

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C(=O)CN1C2=NC=NC3=NNC(=C32)Br)CC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(C(=O)CN1C2=NC=NC3=NNC(=C32)Br)CC4=CC=C(C=C4)Cl

InChI

InChI=1S/C16H14BrClN6O/c17-14-13-15(22-21-14)19-9-20-16(13)24-6-5-23(12(25)8-24)7-10-1-3-11(18)4-2-10/h1-4,9H,5-8H2,(H,19,20,21,22)