2-[3-azanyl-4-(azepan-1-yl)pyrazolo[3,4-d]pyrimidin-1-yl]ethanol

Systemtic Name: 2-[3-azanyl-4-(azepan-1-yl)pyrazolo[3,4-d]pyrimidin-1-yl]ethanol Openeye Name: 2-[3-amino-4-(azepan-1-yl)pyrazolo[3,4-d]pyrimidin-1-yl]ethanol CAS Name: 2-[3-amino-4-(1-azepanyl)-1-pyrazolo[3,4-d]pyrimidinyl]ethanol IUPAC Name: 2-[3-amino-4-(azepan-1-yl)pyrazolo[3,4-d]pyrimidin-1-yl]ethanol Traditional Name: 2-[3-amino-4-(azepan-1-yl)pyrazolo[3,4-d]pyrimidin-1-yl]ethanol Formula: C13H20N6O MolecularWeight: 276.3375

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=NC=NC3=C2C(=NN3CCO)N

Isomeric SMILES

C1CCCN(CC1)C2=NC=NC3=C2C(=NN3CCO)N

InChI

InChI=1S/C13H20N6O/c14-11-10-12(18-5-3-1-2-4-6-18)15-9-16-13(10)19(17-11)7-8-20/h9,20H,1-8H2,(H2,14,17)