1-(2-azanylethyl)-5-[(4-fluorophenyl)methyl]pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 1-(2-azanylethyl)-5-[(4-fluorophenyl)methyl]pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1-(2-aminoethyl)-5-[(4-fluorophenyl)methyl]pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-(2-aminoethyl)-5-[(4-fluorophenyl)methyl]-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 1-(2-aminoethyl)-5-[(4-fluorophenyl)methyl]pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-(2-aminoethyl)-5-(4-fluorobenzyl)pyrazolo[3,4-d]pyrimidin-4-one Formula: C14H14FN5O MolecularWeight: 287.292263

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CN2C=NC3=C(C2=O)C=NN3CCN)F

Isomeric SMILES

C1=CC(=CC=C1CN2C=NC3=C(C2=O)C=NN3CCN)F

InChI

InChI=1S/C14H14FN5O/c15-11-3-1-10(2-4-11)8-19-9-17-13-12(14(19)21)7-18-20(13)6-5-16/h1-4,7,9H,5-6,8,16H2