ethyl 1-ethyl-4-[(4-fluorophenyl)methylamino]pyrazolo[3,4-b]pyridine-5-carboxylate

Systemtic Name: ethyl 1-ethyl-4-[(4-fluorophenyl)methylamino]pyrazolo[3,4-b]pyridine-5-carboxylate Openeye Name: ethyl 1-ethyl-4-[(4-fluorophenyl)methylamino]pyrazolo[3,4-b]pyridine-5-carboxylate CAS Name: 1-ethyl-4-[(4-fluorophenyl)methylamino]-5-pyrazolo[3,4-b]pyridinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-ethyl-4-[(4-fluorophenyl)methylamino]pyrazolo[3,4-b]pyridine-5-carboxylate Traditional Name: 1-ethyl-4-[(4-fluorobenzyl)amino]pyrazolo[3,4-b]pyridine-5-carboxylic acid ethyl ester Formula: C18H19FN4O2 MolecularWeight: 342.367463

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=NC=C(C(=C2C=N1)NCC3=CC=C(C=C3)F)C(=O)OCC

Isomeric SMILES

CCN1C2=NC=C(C(=C2C=N1)NCC3=CC=C(C=C3)F)C(=O)OCC

InChI

InChI=1S/C18H19FN4O2/c1-3-23-17-14(11-22-23)16(15(10-21-17)18(24)25-4-2)20-9-12-5-7-13(19)8-6-12/h5-8,10-11H,3-4,9H2,1-2H3,(H,20,21)