N-[[1-ethyl-6-methyl-4-(oxan-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]methyl]-6-methyl-pyridine-3-carboxamide

Systemtic Name: N-[[1-ethyl-6-methyl-4-(oxan-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]methyl]-6-methyl-pyridine-3-carboxamide Openeye Name: N-[[1-ethyl-6-methyl-4-(tetrahydropyran-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]methyl]-6-methyl-pyridine-3-carboxamide CAS Name: N-[[1-ethyl-6-methyl-4-(4-oxanylamino)-5-pyrazolo[3,4-b]pyridinyl]methyl]-6-methyl-3-pyridinecarboxamide IUPAC Name: N-[[1-ethyl-6-methyl-4-(oxan-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]methyl]-6-methylpyridine-3-carboxamide Traditional Name: N-[[1-ethyl-6-methyl-4-(tetrahydropyran-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]methyl]-6-methyl-nicotinamide Formula: C22H28N6O2 MolecularWeight: 408.49672

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=NC(=C(C(=C2C=N1)NC3CCOCC3)CNC(=O)C4=CN=C(C=C4)C)C

Isomeric SMILES

CCN1C2=NC(=C(C(=C2C=N1)NC3CCOCC3)CNC(=O)C4=CN=C(C=C4)C)C

InChI

InChI=1S/C22H28N6O2/c1-4-28-21-19(13-25-28)20(27-17-7-9-30-10-8-17)18(15(3)26-21)12-24-22(29)16-6-5-14(2)23-11-16/h5-6,11,13,17H,4,7-10,12H2,1-3H3,(H,24,29)(H,26,27)