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

Systemtic Name: [2-[2-(4-methylphenyl)carbonylhydrazinyl]-2-oxidanylidene-ethyl] 6-phenyl-1-propan-2-yl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: [2-[2-(4-methylbenzoyl)hydrazino]-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-[[(4-methylphenyl)-oxomethyl]hydrazo]-2-oxoethyl] ester IUPAC Name: [2-[2-(4-methylbenzoyl)hydrazinyl]-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-keto-2-(N'-p-toluoylhydrazino)ethyl] ester Formula: C26H25N5O4 MolecularWeight: 471.5078

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NNC(=O)COC(=O)C2=CC(=NC3=C2C=NN3C(C)C)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NNC(=O)COC(=O)C2=CC(=NC3=C2C=NN3C(C)C)C4=CC=CC=C4

InChI

InChI=1S/C26H25N5O4/c1-16(2)31-24-21(14-27-31)20(13-22(28-24)18-7-5-4-6-8-18)26(34)35-15-23(32)29-30-25(33)19-11-9-17(3)10-12-19/h4-14,16H,15H2,1-3H3,(H,29,32)(H,30,33)