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

Systemtic Name: N-[[1-ethyl-6-methyl-4-(oxan-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]methyl]-6-pyrrol-1-yl-pyridine-3-carboxamide Openeye Name: N-[[1-ethyl-6-methyl-4-(tetrahydropyran-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]methyl]-6-pyrrol-1-yl-pyridine-3-carboxamide CAS Name: N-[[1-ethyl-6-methyl-4-(4-oxanylamino)-5-pyrazolo[3,4-b]pyridinyl]methyl]-6-(1-pyrrolyl)-3-pyridinecarboxamide IUPAC Name: N-[[1-ethyl-6-methyl-4-(oxan-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]methyl]-6-pyrrol-1-ylpyridine-3-carboxamide Traditional Name: N-[[1-ethyl-6-methyl-4-(tetrahydropyran-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]methyl]-6-pyrrol-1-yl-nicotinamide Formula: C25H29N7O2 MolecularWeight: 459.54346

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=NC(=C(C(=C2C=N1)NC3CCOCC3)CNC(=O)C4=CN=C(C=C4)N5C=CC=C5)C

Isomeric SMILES

CCN1C2=NC(=C(C(=C2C=N1)NC3CCOCC3)CNC(=O)C4=CN=C(C=C4)N5C=CC=C5)C

InChI

InChI=1S/C25H29N7O2/c1-3-32-24-21(16-28-32)23(30-19-8-12-34-13-9-19)20(17(2)29-24)15-27-25(33)18-6-7-22(26-14-18)31-10-4-5-11-31/h4-7,10-11,14,16,19H,3,8-9,12-13,15H2,1-2H3,(H,27,33)(H,29,30)