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

Systemtic Name: [2-(diethylamino)-2-oxidanylidene-ethyl] 1-propan-2-yl-6-thiophen-2-yl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: [2-(diethylamino)-2-oxo-ethyl] 1-isopropyl-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 1-propan-2-yl-6-thiophen-2-yl-4-pyrazolo[3,4-b]pyridinecarboxylic acid [2-(diethylamino)-2-oxoethyl] ester IUPAC Name: [2-(diethylamino)-2-oxoethyl] 1-propan-2-yl-6-thiophen-2-ylpyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 1-isopropyl-6-(2-thienyl)pyrazolo[3,4-b]pyridine-4-carboxylic acid [2-(diethylamino)-2-keto-ethyl] ester Formula: C20H24N4O3S MolecularWeight: 400.49456

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)COC(=O)C1=CC(=NC2=C1C=NN2C(C)C)C3=CC=CS3

Isomeric SMILES

CCN(CC)C(=O)COC(=O)C1=CC(=NC2=C1C=NN2C(C)C)C3=CC=CS3

InChI

InChI=1S/C20H24N4O3S/c1-5-23(6-2)18(25)12-27-20(26)14-10-16(17-8-7-9-28-17)22-19-15(14)11-21-24(19)13(3)4/h7-11,13H,5-6,12H2,1-4H3