5-[(2S)-butan-2-yl]-1-(2-hydroxyethyl)pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 5-[(2S)-butan-2-yl]-1-(2-hydroxyethyl)pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1-(2-hydroxyethyl)-5-[(1S)-1-methylpropyl]pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 5-[(2S)-butan-2-yl]-1-(2-hydroxyethyl)-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 5-[(2S)-butan-2-yl]-1-(2-hydroxyethyl)pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-(2-hydroxyethyl)-5-[(1S)-1-methylpropyl]pyrazolo[3,4-d]pyrimidin-4-one Formula: C11H16N4O2 MolecularWeight: 236.27034

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N1C=NC2=C(C1=O)C=NN2CCO

Isomeric SMILES

CC[C@H](C)N1C=NC2=C(C1=O)C=NN2CCO

InChI

InChI=1S/C11H16N4O2/c1-3-8(2)14-7-12-10-9(11(14)17)6-13-15(10)4-5-16/h6-8,16H,3-5H2,1-2H3/t8-/m0/s1