5-fluoranyl-N-(4-propan-2-yloxyphenyl)-2-(1H-pyrazolo[3,4-b]pyridin-4-ylmethylamino)pyridine-3-carboxamide

Systemtic Name: 5-fluoranyl-N-(4-propan-2-yloxyphenyl)-2-(1H-pyrazolo[3,4-b]pyridin-4-ylmethylamino)pyridine-3-carboxamide Openeye Name: 5-fluoro-N-(4-isopropoxyphenyl)-2-(1H-pyrazolo[3,4-b]pyridin-4-ylmethylamino)pyridine-3-carboxamide CAS Name: 5-fluoro-N-(4-propan-2-yloxyphenyl)-2-(1H-pyrazolo[3,4-b]pyridin-4-ylmethylamino)-3-pyridinecarboxamide IUPAC Name: 5-fluoro-N-(4-propan-2-yloxyphenyl)-2-(1H-pyrazolo[3,4-b]pyridin-4-ylmethylamino)pyridine-3-carboxamide Traditional Name: 5-fluoro-N-(4-isopropoxyphenyl)-2-(1H-pyrazolo[3,4-b]pyridin-4-ylmethylamino)nicotinamide Formula: C22H21FN6O2 MolecularWeight: 420.439543

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=C(C=C1)NC(=O)C2=CC(=CN=C2NCC3=C4C=NNC4=NC=C3)F

Isomeric SMILES

CC(C)OC1=CC=C(C=C1)NC(=O)C2=CC(=CN=C2NCC3=C4C=NNC4=NC=C3)F

InChI

InChI=1S/C22H21FN6O2/c1-13(2)31-17-5-3-16(4-6-17)28-22(30)18-9-15(23)11-26-20(18)25-10-14-7-8-24-21-19(14)12-27-29-21/h3-9,11-13H,10H2,1-2H3,(H,25,26)(H,28,30)(H,24,27,29)