[4-(3-bromanyl-2H-pyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]-(furan-2-yl)methanone

Systemtic Name: [4-(3-bromanyl-2H-pyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]-(furan-2-yl)methanone Openeye Name: [4-(3-bromo-2H-pyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]-(2-furyl)methanone CAS Name: [4-(3-bromo-2H-pyrazolo[3,4-d]pyrimidin-4-yl)-1-piperazinyl]-(2-furanyl)methanone IUPAC Name: [4-(3-bromo-2H-pyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]-(furan-2-yl)methanone Traditional Name: [4-(3-bromo-2H-pyrazolo[3,4-d]pyrimidin-4-yl)piperazino]-(2-furyl)methanone Formula: C14H13BrN6O2 MolecularWeight: 377.19602

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=NC3=NNC(=C32)Br)C(=O)C4=CC=CO4

Isomeric SMILES

C1CN(CCN1C2=NC=NC3=NNC(=C32)Br)C(=O)C4=CC=CO4

InChI

InChI=1S/C14H13BrN6O2/c15-11-10-12(19-18-11)16-8-17-13(10)20-3-5-21(6-4-20)14(22)9-2-1-7-23-9/h1-2,7-8H,3-6H2,(H,16,17,18,19)