N-(3,5-dimethoxyphenyl)-1-(phenylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide

Systemtic Name: N-(3,5-dimethoxyphenyl)-1-(phenylmethyl)pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: 1-benzyl-N-(3,5-dimethoxyphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: N-(3,5-dimethoxyphenyl)-1-(phenylmethyl)-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 1-benzyl-N-(3,5-dimethoxyphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: 1-benzyl-N-(3,5-dimethoxyphenyl)pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C22H20N4O3 MolecularWeight: 388.4192

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1)NC(=O)C2=CN=C3C(=C2)C=NN3CC4=CC=CC=C4)OC

Isomeric SMILES

COC1=CC(=CC(=C1)NC(=O)C2=CN=C3C(=C2)C=NN3CC4=CC=CC=C4)OC

InChI

InChI=1S/C22H20N4O3/c1-28-19-9-18(10-20(11-19)29-2)25-22(27)17-8-16-13-24-26(21(16)23-12-17)14-15-6-4-3-5-7-15/h3-13H,14H2,1-2H3,(H,25,27)