6-cyclopropyl-1-propan-2-yl-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]pyrazolo[3,4-b]pyridine-4-carboxamide

Systemtic Name: 6-cyclopropyl-1-propan-2-yl-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]pyrazolo[3,4-b]pyridine-4-carboxamide Openeye Name: 6-cyclopropyl-1-isopropyl-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]pyrazolo[3,4-b]pyridine-4-carboxamide CAS Name: 6-cyclopropyl-1-propan-2-yl-N-[[2-(1-pyrrolidin-1-iumylmethyl)phenyl]methyl]-4-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 6-cyclopropyl-1-propan-2-yl-N-[[2-(pyrrolidin-1-ium-1-ylmethyl)phenyl]methyl]pyrazolo[3,4-b]pyridine-4-carboxamide Traditional Name: 6-cyclopropyl-1-isopropyl-N-[2-(pyrrolidin-1-ium-1-ylmethyl)benzyl]pyrazolo[3,4-b]pyridine-4-carboxamide Formula: C25H32N5O+ MolecularWeight: 418.55448

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C2=C(C=N1)C(=CC(=N2)C3CC3)C(=O)NCC4=CC=CC=C4C[NH+]5CCCC5

Isomeric SMILES

CC(C)N1C2=C(C=N1)C(=CC(=N2)C3CC3)C(=O)NCC4=CC=CC=C4C[NH+]5CCCC5

InChI

InChI=1S/C25H31N5O/c1-17(2)30-24-22(15-27-30)21(13-23(28-24)18-9-10-18)25(31)26-14-19-7-3-4-8-20(19)16-29-11-5-6-12-29/h3-4,7-8,13,15,17-18H,5-6,9-12,14,16H2,1-2H3,(H,26,31)/p+1