4-[(2-fluoranyl-4-iodanyl-phenyl)amino]-N-(2-methyl-1-oxidanyl-propan-2-yl)oxy-1H-pyrazolo[3,4-b]pyridine-5-carboxamide

Systemtic Name: 4-[(2-fluoranyl-4-iodanyl-phenyl)amino]-N-(2-methyl-1-oxidanyl-propan-2-yl)oxy-1H-pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: 4-(2-fluoro-4-iodo-anilino)-N-(2-hydroxy-1,1-dimethyl-ethoxy)-1H-pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: 4-(2-fluoro-4-iodoanilino)-N-(1-hydroxy-2-methylpropan-2-yl)oxy-1H-pyrazolo[3,4-b]pyridine-5-carboxamide IUPAC Name: 4-(2-fluoro-4-iodoanilino)-N-(1-hydroxy-2-methylpropan-2-yl)oxy-1H-pyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: 4-(2-fluoro-4-iodo-anilino)-N-(2-hydroxy-1,1-dimethyl-ethoxy)-1H-pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C17H17FIN5O3 MolecularWeight: 485.251453

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CO)ONC(=O)C1=CN=C2C(=C1NC3=C(C=C(C=C3)I)F)C=NN2

Isomeric SMILES

CC(C)(CO)ONC(=O)C1=CN=C2C(=C1NC3=C(C=C(C=C3)I)F)C=NN2

InChI

InChI=1S/C17H17FIN5O3/c1-17(2,8-25)27-24-16(26)11-6-20-15-10(7-21-23-15)14(11)22-13-4-3-9(19)5-12(13)18/h3-7,25H,8H2,1-2H3,(H,24,26)(H2,20,21,22,23)