N-[(2-fluorophenyl)methyl]-1-(phenylmethyl)-4-thiophen-2-yl-pyrazolo[3,4-b]pyridine-3-carboxamide

Systemtic Name: N-[(2-fluorophenyl)methyl]-1-(phenylmethyl)-4-thiophen-2-yl-pyrazolo[3,4-b]pyridine-3-carboxamide Openeye Name: 1-benzyl-N-[(2-fluorophenyl)methyl]-4-(2-thienyl)pyrazolo[3,4-b]pyridine-3-carboxamide CAS Name: N-[(2-fluorophenyl)methyl]-1-(phenylmethyl)-4-thiophen-2-yl-3-pyrazolo[3,4-b]pyridinecarboxamide IUPAC Name: 1-benzyl-N-[(2-fluorophenyl)methyl]-4-thiophen-2-ylpyrazolo[3,4-b]pyridine-3-carboxamide Traditional Name: 1-benzyl-N-(2-fluorobenzyl)-4-(2-thienyl)pyrazolo[3,4-b]pyridine-3-carboxamide Formula: C25H19FN4OS MolecularWeight: 442.507963

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=NC=CC(=C3C(=N2)C(=O)NCC4=CC=CC=C4F)C5=CC=CS5

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=NC=CC(=C3C(=N2)C(=O)NCC4=CC=CC=C4F)C5=CC=CS5

InChI

InChI=1S/C25H19FN4OS/c26-20-10-5-4-9-18(20)15-28-25(31)23-22-19(21-11-6-14-32-21)12-13-27-24(22)30(29-23)16-17-7-2-1-3-8-17/h1-14H,15-16H2,(H,28,31)