N-[6-[3-(4-methylpiperazin-1-yl)propyl]-2-[2-(trifluoromethyl)phenyl]pyrimidin-4-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine

Systemtic Name: N-[6-[3-(4-methylpiperazin-1-yl)propyl]-2-[2-(trifluoromethyl)phenyl]pyrimidin-4-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine Openeye Name: N-[6-[3-(4-methylpiperazin-1-yl)propyl]-2-[2-(trifluoromethyl)phenyl]pyrimidin-4-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine CAS Name: N-[6-[3-(4-methyl-1-piperazinyl)propyl]-2-[2-(trifluoromethyl)phenyl]-4-pyrimidinyl]-2H-pyrazolo[3,4-b]pyridin-3-amine IUPAC Name: N-[6-[3-(4-methylpiperazin-1-yl)propyl]-2-[2-(trifluoromethyl)phenyl]pyrimidin-4-yl]-2H-pyrazolo[3,4-b]pyridin-3-amine Traditional Name: [6-[3-(4-methylpiperazino)propyl]-2-[2-(trifluoromethyl)phenyl]pyrimidin-4-yl]-(2H-pyrazolo[3,4-b]pyridin-3-yl)amine Formula: C25H27F3N8 MolecularWeight: 496.53069

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCC2=CC(=NC(=N2)C3=CC=CC=C3C(F)(F)F)NC4=C5C=CC=NC5=NN4

Isomeric SMILES

CN1CCN(CC1)CCCC2=CC(=NC(=N2)C3=CC=CC=C3C(F)(F)F)NC4=C5C=CC=NC5=NN4

InChI

InChI=1S/C25H27F3N8/c1-35-12-14-36(15-13-35)11-5-6-17-16-21(32-24-19-8-4-10-29-22(19)33-34-24)31-23(30-17)18-7-2-3-9-20(18)25(26,27)28/h2-4,7-10,16H,5-6,11-15H2,1H3,(H2,29,30,31,32,33,34)