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

Systemtic Name: [2-(ethylcarbamoylamino)-2-oxidanylidene-ethyl] 6-phenyl-1-propan-2-yl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: [2-(ethylcarbamoylamino)-2-oxo-ethyl] 1-isopropyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylate CAS Name: 6-phenyl-1-propan-2-yl-4-pyrazolo[3,4-b]pyridinecarboxylic acid [2-(ethylcarbamoylamino)-2-oxoethyl] ester IUPAC Name: [2-(ethylcarbamoylamino)-2-oxoethyl] 6-phenyl-1-propan-2-ylpyrazolo[3,4-b]pyridine-4-carboxylate Traditional Name: 1-isopropyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxylic acid [2-(ethylcarbamoylamino)-2-keto-ethyl] ester Formula: C21H23N5O4 MolecularWeight: 409.43842

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H23N5O4/c1-4-22-21(29)25-18(27)12-30-20(28)15-10-17(14-8-6-5-7-9-14)24-19-16(15)11-23-26(19)13(2)3/h5-11,13H,4,12H2,1-3H3,(H2,22,25,27,29)