N-(1-adamantyl)-1-(4-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: N-(1-adamantyl)-1-(4-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-(1-adamantyl)-1-(4-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-(1-adamantyl)-1-(4-fluorophenyl)-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: N-(1-adamantyl)-1-(4-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: 1-adamantyl-[1-(4-fluorophenyl)pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C21H22FN5 MolecularWeight: 363.431283

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)NC4=NC=NC5=C4C=NN5C6=CC=C(C=C6)F

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)NC4=NC=NC5=C4C=NN5C6=CC=C(C=C6)F

InChI

InChI=1S/C21H22FN5/c22-16-1-3-17(4-2-16)27-20-18(11-25-27)19(23-12-24-20)26-21-8-13-5-14(9-21)7-15(6-13)10-21/h1-4,11-15H,5-10H2,(H,23,24,26)