1-(4-fluorophenyl)-5-[(2S)-2-oxidanyl-3-phenylmethoxy-propyl]pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 1-(4-fluorophenyl)-5-[(2S)-2-oxidanyl-3-phenylmethoxy-propyl]pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 5-[(2S)-3-benzyloxy-2-hydroxy-propyl]-1-(4-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-(4-fluorophenyl)-5-[(2S)-2-hydroxy-3-phenylmethoxypropyl]-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 1-(4-fluorophenyl)-5-[(2S)-2-hydroxy-3-phenylmethoxypropyl]pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 5-[(2S)-3-benzoxy-2-hydroxy-propyl]-1-(4-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-one Formula: C21H19FN4O3 MolecularWeight: 394.398963

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COCC(CN2C=NC3=C(C2=O)C=NN3C4=CC=C(C=C4)F)O

Isomeric SMILES

C1=CC=C(C=C1)COC[C@H](CN2C=NC3=C(C2=O)C=NN3C4=CC=C(C=C4)F)O

InChI

InChI=1S/C21H19FN4O3/c22-16-6-8-17(9-7-16)26-20-19(10-24-26)21(28)25(14-23-20)11-18(27)13-29-12-15-4-2-1-3-5-15/h1-10,14,18,27H,11-13H2/t18-/m0/s1