N-(3-chloranyl-2-fluoranyl-phenyl)-1-(phenylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide

Systemtic Name: N-(3-chloranyl-2-fluoranyl-phenyl)-1-(phenylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: 1-benzyl-N-(3-chloro-2-fluoro-phenyl)pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: N-(3-chloro-2-fluorophenyl)-1-(phenylmethyl)-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 1-benzyl-N-(3-chloro-2-fluorophenyl)pyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: 1-benzyl-N-(3-chloro-2-fluoro-phenyl)pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C20H14ClFN4O MolecularWeight: 380.802763

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=NC=C(C=C3C=N2)C(=O)NC4=C(C(=CC=C4)Cl)F

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=NC=C(C=C3C=N2)C(=O)NC4=C(C(=CC=C4)Cl)F

InChI

InChI=1S/C20H14ClFN4O/c21-16-7-4-8-17(18(16)22)25-20(27)15-9-14-11-24-26(19(14)23-10-15)12-13-5-2-1-3-6-13/h1-11H,12H2,(H,25,27)