N-[(3-fluoranyl-4-methyl-phenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: N-[(3-fluoranyl-4-methyl-phenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-[(3-fluoro-4-methyl-phenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-[(3-fluoro-4-methylphenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine IUPAC Name: N-[(3-fluoro-4-methylphenyl)methyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: (3-fluoro-4-methyl-benzyl)-(1H-pyrazolo[3,4-d]pyrimidin-4-yl)amine Formula: C13H12FN5 MolecularWeight: 257.266283

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)CNC2=NC=NC3=C2C=NN3)F

Isomeric SMILES

CC1=C(C=C(C=C1)CNC2=NC=NC3=C2C=NN3)F

InChI

InChI=1S/C13H12FN5/c1-8-2-3-9(4-11(8)14)5-15-12-10-6-18-19-13(10)17-7-16-12/h2-4,6-7H,5H2,1H3,(H2,15,16,17,18,19)