N-butyl-1-[(3-fluorophenyl)methyl]-N-methyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxamide

Systemtic Name: N-butyl-1-[(3-fluorophenyl)methyl]-N-methyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxamide Openeye Name: N-butyl-1-[(3-fluorophenyl)methyl]-N-methyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxamide CAS Name: N-butyl-1-[(3-fluorophenyl)methyl]-N-methyl-6-phenyl-4-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: N-butyl-1-[(3-fluorophenyl)methyl]-N-methyl-6-phenylpyrazolo[3,4-b]pyridine-4-carboxamide Traditional Name: N-butyl-1-(3-fluorobenzyl)-N-methyl-6-phenyl-pyrazolo[3,4-b]pyridine-4-carboxamide Formula: C25H25FN4O MolecularWeight: 416.490603

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(=O)C1=CC(=NC2=C1C=NN2CC3=CC(=CC=C3)F)C4=CC=CC=C4

Isomeric SMILES

CCCCN(C)C(=O)C1=CC(=NC2=C1C=NN2CC3=CC(=CC=C3)F)C4=CC=CC=C4

InChI

InChI=1S/C25H25FN4O/c1-3-4-13-29(2)25(31)21-15-23(19-10-6-5-7-11-19)28-24-22(21)16-27-30(24)17-18-9-8-12-20(26)14-18/h5-12,14-16H,3-4,13,17H2,1-2H3