[2-(2-methylpropylcarbamoylamino)-2-oxidanylidene-ethyl] 6-(furan-2-yl)-1-propan-2-yl-pyrazolo[3,4-b]pyridine-4-carboxylate

Systemtic Name: [2-(2-methylpropylcarbamoylamino)-2-oxidanylidene-ethyl] 6-(furan-2-yl)-1-propan-2-yl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: [2-(isobutylcarbamoylamino)-2-oxo-ethyl] 6-(2-furyl)-1-isopropyl-pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 6-(2-furanyl)-1-propan-2-yl-4-pyrazolo[3,4-b]pyridinecarboxylic acid [2-[[(2-methylpropylamino)-oxomethyl]amino]-2-oxoethyl] ester IUPAC Name: [2-(2-methylpropylcarbamoylamino)-2-oxoethyl] 6-(furan-2-yl)-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 6-(2-furyl)-1-isopropyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid [2-(isobutylcarbamoylamino)-2-keto-ethyl] ester Formula: C21H25N5O5 MolecularWeight: 427.4537

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)NC(=O)COC(=O)C1=CC(=NC2=C1C=NN2C(C)C)C3=CC=CO3

Isomeric SMILES

CC(C)CNC(=O)NC(=O)COC(=O)C1=CC(=NC2=C1C=NN2C(C)C)C3=CC=CO3

InChI

InChI=1S/C21H25N5O5/c1-12(2)9-22-21(29)25-18(27)11-31-20(28)14-8-16(17-6-5-7-30-17)24-19-15(14)10-23-26(19)13(3)4/h5-8,10,12-13H,9,11H2,1-4H3,(H2,22,25,27,29)