3,6-dicyclopropyl-1-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]pyrazolo[3,4-b]pyridine-4-carboxylic acid

Systemtic Name: 3,6-dicyclopropyl-1-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]pyrazolo[3,4-b]pyridine-4-carboxylic acid Openeye Name: 3,6-dicyclopropyl-1-[2-(isopropylamino)-2-oxo-ethyl]pyrazolo[3,4-b]pyridine-4-carboxylic acid CAS Name: 3,6-dicyclopropyl-1-[2-oxo-2-(propan-2-ylamino)ethyl]-4-pyrazolo[3,4-b]pyridinecarboxylic acid IUPAC Name: 3,6-dicyclopropyl-1-[2-oxo-2-(propan-2-ylamino)ethyl]pyrazolo[3,4-b]pyridine-4-carboxylic acid Traditional Name: 3,6-dicyclopropyl-1-[2-(isopropylamino)-2-keto-ethyl]pyrazolo[3,4-b]pyridine-4-carboxylic acid Formula: C18H22N4O3 MolecularWeight: 342.39228

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CN1C2=C(C(=CC(=N2)C3CC3)C(=O)O)C(=N1)C4CC4

Isomeric SMILES

CC(C)NC(=O)CN1C2=C(C(=CC(=N2)C3CC3)C(=O)O)C(=N1)C4CC4

InChI

InChI=1S/C18H22N4O3/c1-9(2)19-14(23)8-22-17-15(16(21-22)11-5-6-11)12(18(24)25)7-13(20-17)10-3-4-10/h7,9-11H,3-6,8H2,1-2H3,(H,19,23)(H,24,25)