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

Systemtic Name: 6-methyl-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-6-methyl-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide CAS Name: 6-methyl-N-[[6-(4-morpholinyl)-3-pyridin-1-iumyl]methyl]-1-propan-2-yl-5-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 6-methyl-N-[(6-morpholin-4-ylpyridin-1-ium-3-yl)methyl]-1-propan-2-ylpyrazolo[3,4-b]pyridine-5-carboxamide Traditional Name: 1-isopropyl-6-methyl-N-[(6-morpholinopyridin-1-ium-3-yl)methyl]pyrazolo[3,4-b]pyridine-5-carboxamide Formula: C21H27N6O2+ MolecularWeight: 395.47808

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C2C=NN(C2=N1)C(C)C)C(=O)NCC3=C[NH+]=C(C=C3)N4CCOCC4

Isomeric SMILES

CC1=C(C=C2C=NN(C2=N1)C(C)C)C(=O)NCC3=C[NH+]=C(C=C3)N4CCOCC4

InChI

InChI=1S/C21H26N6O2/c1-14(2)27-20-17(13-24-27)10-18(15(3)25-20)21(28)23-12-16-4-5-19(22-11-16)26-6-8-29-9-7-26/h4-5,10-11,13-14H,6-9,12H2,1-3H3,(H,23,28)/p+1