N-cyclohexyl-6-[4-(4-fluorophenyl)piperazin-1-yl]-1-methyl-pyrazolo[3,4-d]pyrimidin-4-amine

Systemtic Name: N-cyclohexyl-6-[4-(4-fluorophenyl)piperazin-1-yl]-1-methyl-pyrazolo[3,4-d]pyrimidin-4-amine Openeye Name: N-cyclohexyl-6-[4-(4-fluorophenyl)piperazin-1-yl]-1-methyl-pyrazolo[3,4-d]pyrimidin-4-amine CAS Name: N-cyclohexyl-6-[4-(4-fluorophenyl)-1-piperazinyl]-1-methyl-4-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: N-cyclohexyl-6-[4-(4-fluorophenyl)piperazin-1-yl]-1-methylpyrazolo[3,4-d]pyrimidin-4-amine Traditional Name: cyclohexyl-[6-[4-(4-fluorophenyl)piperazino]-1-methyl-pyrazolo[3,4-d]pyrimidin-4-yl]amine Formula: C22H28FN7 MolecularWeight: 409.503023

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC(=N2)N3CCN(CC3)C4=CC=C(C=C4)F)NC5CCCCC5

Isomeric SMILES

CN1C2=C(C=N1)C(=NC(=N2)N3CCN(CC3)C4=CC=C(C=C4)F)NC5CCCCC5

InChI

InChI=1S/C22H28FN7/c1-28-21-19(15-24-28)20(25-17-5-3-2-4-6-17)26-22(27-21)30-13-11-29(12-14-30)18-9-7-16(23)8-10-18/h7-10,15,17H,2-6,11-14H2,1H3,(H,25,26,27)