2-[[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methyl]-1,3-benzoxazole

Systemtic Name: 2-[[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methyl]-1,3-benzoxazole Openeye Name: 2-[[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methyl]-1,3-benzoxazole CAS Name: 2-[[4-(1-methyl-4-pyrazolo[3,4-d]pyrimidinyl)-1-piperazinyl]methyl]-1,3-benzoxazole IUPAC Name: 2-[[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-yl]methyl]-1,3-benzoxazole Traditional Name: 2-[[4-(1-methylpyrazolo[3,4-d]pyrimidin-4-yl)piperazino]methyl]-1,3-benzoxazole Formula: C18H19N7O MolecularWeight: 349.38976

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC=N2)N3CCN(CC3)CC4=NC5=CC=CC=C5O4

Isomeric SMILES

CN1C2=C(C=N1)C(=NC=N2)N3CCN(CC3)CC4=NC5=CC=CC=C5O4

InChI

InChI=1S/C18H19N7O/c1-23-17-13(10-21-23)18(20-12-19-17)25-8-6-24(7-9-25)11-16-22-14-4-2-3-5-15(14)26-16/h2-5,10,12H,6-9,11H2,1H3