2-fluoranyl-N-[3-methyl-6-[(4-methylphenyl)amino]-1-phenyl-pyrazolo[3,4-b]pyridin-5-yl]benzamide

Systemtic Name: 2-fluoranyl-N-[3-methyl-6-[(4-methylphenyl)amino]-1-phenyl-pyrazolo[3,4-b]pyridin-5-yl]benzamide Openeye Name: 2-fluoro-N-[3-methyl-6-(4-methylanilino)-1-phenyl-pyrazolo[3,4-b]pyridin-5-yl]benzamide CAS Name: 2-fluoro-N-[3-methyl-6-(4-methylanilino)-1-phenyl-5-pyrazolo[3,4-b]pyridinyl]benzamide IUPAC Name: 2-fluoro-N-[3-methyl-6-(4-methylanilino)-1-phenylpyrazolo[3,4-b]pyridin-5-yl]benzamide Traditional Name: 2-fluoro-N-[3-methyl-1-phenyl-6-(p-toluidino)pyrazolo[3,4-b]pyridin-5-yl]benzamide Formula: C27H22FN5O MolecularWeight: 451.494883

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=C(C=C3C(=NN(C3=N2)C4=CC=CC=C4)C)NC(=O)C5=CC=CC=C5F

Isomeric SMILES

CC1=CC=C(C=C1)NC2=C(C=C3C(=NN(C3=N2)C4=CC=CC=C4)C)NC(=O)C5=CC=CC=C5F

InChI

InChI=1S/C27H22FN5O/c1-17-12-14-19(15-13-17)29-25-24(30-27(34)21-10-6-7-11-23(21)28)16-22-18(2)32-33(26(22)31-25)20-8-4-3-5-9-20/h3-16H,1-2H3,(H,29,31)(H,30,34)