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

Systemtic Name: N-[[1,6-diethyl-4-(oxan-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]methyl]-6-pyrrol-1-yl-pyridine-3-carboxamide Openeye Name: N-[[1,6-diethyl-4-(tetrahydropyran-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]methyl]-6-pyrrol-1-yl-pyridine-3-carboxamide CAS Name: N-[[1,6-diethyl-4-(4-oxanylamino)-5-pyrazolo[3,4-b]pyridinyl]methyl]-6-(1-pyrrolyl)-3-pyridinecarboxamide IUPAC Name: N-[[1,6-diethyl-4-(oxan-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]methyl]-6-pyrrol-1-ylpyridine-3-carboxamide Traditional Name: N-[[1,6-diethyl-4-(tetrahydropyran-4-ylamino)pyrazolo[3,4-b]pyridin-5-yl]methyl]-6-pyrrol-1-yl-nicotinamide Formula: C26H31N7O2 MolecularWeight: 473.57004

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C2C=NN(C2=N1)CC)NC3CCOCC3)CNC(=O)C4=CN=C(C=C4)N5C=CC=C5

Isomeric SMILES

CCC1=C(C(=C2C=NN(C2=N1)CC)NC3CCOCC3)CNC(=O)C4=CN=C(C=C4)N5C=CC=C5

InChI

InChI=1S/C26H31N7O2/c1-3-22-20(16-28-26(34)18-7-8-23(27-15-18)32-11-5-6-12-32)24(30-19-9-13-35-14-10-19)21-17-29-33(4-2)25(21)31-22/h5-8,11-12,15,17,19H,3-4,9-10,13-14,16H2,1-2H3,(H,28,34)(H,30,31)