N-(4-fluoranyl-3-methoxy-phenyl)-1-naphthalen-1-yl-pyrazolo[3,4-d]pyrimidin-6-amine

Systemtic Name: N-(4-fluoranyl-3-methoxy-phenyl)-1-naphthalen-1-yl-pyrazolo[3,4-d]pyrimidin-6-amine Openeye Name: N-(4-fluoro-3-methoxy-phenyl)-1-(1-naphthyl)pyrazolo[3,4-d]pyrimidin-6-amine CAS Name: N-(4-fluoro-3-methoxyphenyl)-1-(1-naphthalenyl)-6-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: N-(4-fluoro-3-methoxyphenyl)-1-naphthalen-1-ylpyrazolo[3,4-d]pyrimidin-6-amine Traditional Name: (4-fluoro-3-methoxy-phenyl)-[1-(1-naphthyl)pyrazolo[3,4-d]pyrimidin-6-yl]amine Formula: C22H16FN5O MolecularWeight: 385.393743

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC2=NC=C3C=NN(C3=N2)C4=CC=CC5=CC=CC=C54)F

Isomeric SMILES

COC1=C(C=CC(=C1)NC2=NC=C3C=NN(C3=N2)C4=CC=CC5=CC=CC=C54)F

InChI

InChI=1S/C22H16FN5O/c1-29-20-11-16(9-10-18(20)23)26-22-24-12-15-13-25-28(21(15)27-22)19-8-4-6-14-5-2-3-7-17(14)19/h2-13H,1H3,(H,24,26,27)