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

Systemtic Name: [2-oxidanylidene-2-(pentylamino)ethyl] 6-phenyl-1-propan-2-yl-pyrazolo[3,4-b]pyridine-4-carboxylate Openeye Name: [2-oxo-2-(pentylamino)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-oxo-2-(pentylamino)ethyl] ester IUPAC Name: [2-oxo-2-(pentylamino)ethyl] 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-(amylamino)-2-keto-ethyl] ester Formula: C23H28N4O3 MolecularWeight: 408.49342

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H28N4O3/c1-4-5-9-12-24-21(28)15-30-23(29)18-13-20(17-10-7-6-8-11-17)26-22-19(18)14-25-27(22)16(2)3/h6-8,10-11,13-14,16H,4-5,9,12,15H2,1-3H3,(H,24,28)