N-[3,5-bis(fluoranyl)-4-phenethyloxy-cyclohexyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: N-[3,5-bis(fluoranyl)-4-phenethyloxy-cyclohexyl]-1H-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-(3,5-difluoro-4-phenethyloxy-cyclohexyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-(3,5-difluoro-4-phenethyloxycyclohexyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine IUPAC Name: N-(3,5-difluoro-4-phenethyloxycyclohexyl)-1H-pyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: (3,5-difluoro-4-phenethyloxy-cyclohexyl)-(1H-pyrazolo[3,4-d]pyrimidin-4-yl)amine Formula: C19H21F2N5O MolecularWeight: 373.399746

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC(C(C1F)OCCC2=CC=CC=C2)F)NC3=NC=NC4=C3C=NN4

Isomeric SMILES

C1C(CC(C(C1F)OCCC2=CC=CC=C2)F)NC3=NC=NC4=C3C=NN4

InChI

InChI=1S/C19H21F2N5O/c20-15-8-13(25-18-14-10-24-26-19(14)23-11-22-18)9-16(21)17(15)27-7-6-12-4-2-1-3-5-12/h1-5,10-11,13,15-17H,6-9H2,(H2,22,23,24,25,26)