ethyl 4-(3-bromanyl-2H-pyrazolo[3,4-d]pyrimidin-4-yl)piperazine-1-carboxylate

Systemtic Name: ethyl 4-(3-bromanyl-2H-pyrazolo[3,4-d]pyrimidin-4-yl)piperazine-1-carboxylate Openeye Name: ethyl 4-(3-bromo-2H-pyrazolo[3,4-d]pyrimidin-4-yl)piperazine-1-carboxylate CAS Name: 4-(3-bromo-2H-pyrazolo[3,4-d]pyrimidin-4-yl)-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3-bromo-2H-pyrazolo[3,4-d]pyrimidin-4-yl)piperazine-1-carboxylate Traditional Name: 4-(3-bromo-2H-pyrazolo[3,4-d]pyrimidin-4-yl)piperazine-1-carboxylic acid ethyl ester Formula: C12H15BrN6O2 MolecularWeight: 355.1905

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=NC=NC3=NNC(=C32)Br

Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=NC=NC3=NNC(=C32)Br

InChI

InChI=1S/C12H15BrN6O2/c1-2-21-12(20)19-5-3-18(4-6-19)11-8-9(13)16-17-10(8)14-7-15-11/h7H,2-6H2,1H3,(H,14,15,16,17)