2-fluoranyl-N-[4-[(1-phenyl-6-propan-2-yl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]cyclohexyl]benzamide

Systemtic Name: 2-fluoranyl-N-[4-[(1-phenyl-6-propan-2-yl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]cyclohexyl]benzamide Openeye Name: 2-fluoro-N-[4-[(6-isopropyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]cyclohexyl]benzamide CAS Name: 2-fluoro-N-[4-[(1-phenyl-6-propan-2-yl-4-pyrazolo[3,4-d]pyrimidinyl)amino]cyclohexyl]benzamide IUPAC Name: 2-fluoro-N-[4-[(1-phenyl-6-propan-2-ylpyrazolo[3,4-d]pyrimidin-4-yl)amino]cyclohexyl]benzamide Traditional Name: 2-fluoro-N-[4-[(6-isopropyl-1-phenyl-pyrazolo[3,4-d]pyrimidin-4-yl)amino]cyclohexyl]benzamide Formula: C27H29FN6O MolecularWeight: 472.557163

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NC2=C(C=NN2C3=CC=CC=C3)C(=N1)NC4CCC(CC4)NC(=O)C5=CC=CC=C5F

Isomeric SMILES

CC(C)C1=NC2=C(C=NN2C3=CC=CC=C3)C(=N1)NC4CCC(CC4)NC(=O)C5=CC=CC=C5F

InChI

InChI=1S/C27H29FN6O/c1-17(2)24-32-25(22-16-29-34(26(22)33-24)20-8-4-3-5-9-20)30-18-12-14-19(15-13-18)31-27(35)21-10-6-7-11-23(21)28/h3-11,16-19H,12-15H2,1-2H3,(H,31,35)(H,30,32,33)