2-[4-(6-cyclopropyl-1-propan-2-yl-pyrazolo[3,4-b]pyridin-4-yl)carbonylpiperazin-1-ium-1-yl]-N-propyl-ethanamide

Systemtic Name: 2-[4-(6-cyclopropyl-1-propan-2-yl-pyrazolo[3,4-b]pyridin-4-yl)carbonylpiperazin-1-ium-1-yl]-N-propyl-ethanamide Openeye Name: 2-[4-(6-cyclopropyl-1-isopropyl-pyrazolo[3,4-b]pyridine-4-carbonyl)piperazin-1-ium-1-yl]-N-propyl-acetamide CAS Name: 2-[4-[(6-cyclopropyl-1-propan-2-yl-4-pyrazolo[3,4-b]pyridinyl)-oxomethyl]-1-piperazin-1-iumyl]-N-propylacetamide IUPAC Name: 2-[4-(6-cyclopropyl-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carbonyl)piperazin-1-ium-1-yl]-N-propylacetamide Traditional Name: 2-[4-(6-cyclopropyl-1-isopropyl-pyrazolo[3,4-b]pyridine-4-carbonyl)piperazin-1-ium-1-yl]-N-propyl-acetamide Formula: C22H33N6O2+ MolecularWeight: 413.53642

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C[NH+]1CCN(CC1)C(=O)C2=CC(=NC3=C2C=NN3C(C)C)C4CC4

Isomeric SMILES

CCCNC(=O)C[NH+]1CCN(CC1)C(=O)C2=CC(=NC3=C2C=NN3C(C)C)C4CC4

InChI

InChI=1S/C22H32N6O2/c1-4-7-23-20(29)14-26-8-10-27(11-9-26)22(30)17-12-19(16-5-6-16)25-21-18(17)13-24-28(21)15(2)3/h12-13,15-16H,4-11,14H2,1-3H3,(H,23,29)/p+1