N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-1-propan-2-yl-pyrazolo[3,4-b]pyridine-5-carboxamide

Systemtic Name: N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-1-propan-2-yl-pyrazolo[3,4-b]pyridine-5-carboxamide Openeye Name: 1-isopropyl-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: N-[[6-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]-1-propan-2-yl-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: 1-isopropyl-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C20H25N6O2+ MolecularWeight: 381.4515

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=NC=C(C=C2C=N1)C(=O)NCC3=C[NH+]=C(C=C3)N4CCOCC4

Isomeric SMILES

CC(C)N1C2=NC=C(C=C2C=N1)C(=O)NCC3=C[NH+]=C(C=C3)N4CCOCC4

InChI

InChI=1S/C20H24N6O2/c1-14(2)26-19-16(13-24-26)9-17(12-22-19)20(27)23-11-15-3-4-18(21-10-15)25-5-7-28-8-6-25/h3-4,9-10,12-14H,5-8,11H2,1-2H3,(H,23,27)/p+1