N-[4-(4-morpholin-4-yl-1H-pyrazolo[3,4-d]pyrimidin-6-yl)phenyl]pyridine-3-carboxamide

Systemtic Name: N-[4-(4-morpholin-4-yl-1H-pyrazolo[3,4-d]pyrimidin-6-yl)phenyl]pyridine-3-carboxamide Openeye Name: N-[4-(4-morpholino-1H-pyrazolo[3,4-d]pyrimidin-6-yl)phenyl]pyridine-3-carboxamide CAS Name: N-[4-[4-(4-morpholinyl)-1H-pyrazolo[3,4-d]pyrimidin-6-yl]phenyl]-3-pyridinecarboxamide IUPAC Name: N-[4-(4-morpholin-4-yl-1H-pyrazolo[3,4-d]pyrimidin-6-yl)phenyl]pyridine-3-carboxamide Traditional Name: N-[4-(4-morpholino-1H-pyrazolo[3,4-d]pyrimidin-6-yl)phenyl]nicotinamide Formula: C21H19N7O2 MolecularWeight: 401.42126

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=NC(=NC3=C2C=NN3)C4=CC=C(C=C4)NC(=O)C5=CN=CC=C5

Isomeric SMILES

C1COCCN1C2=NC(=NC3=C2C=NN3)C4=CC=C(C=C4)NC(=O)C5=CN=CC=C5

InChI

InChI=1S/C21H19N7O2/c29-21(15-2-1-7-22-12-15)24-16-5-3-14(4-6-16)18-25-19-17(13-23-27-19)20(26-18)28-8-10-30-11-9-28/h1-7,12-13H,8-11H2,(H,24,29)(H,23,25,26,27)