3-(3-fluorophenyl)-5-[(phenethylamino)methyl]-1-phenyl-2H-pyrazolo[3,4-b]pyridin-6-one

Systemtic Name: 3-(3-fluorophenyl)-5-[(phenethylamino)methyl]-1-phenyl-2H-pyrazolo[3,4-b]pyridin-6-one Openeye Name: 3-(3-fluorophenyl)-5-[(phenethylamino)methyl]-1-phenyl-2H-pyrazolo[3,4-b]pyridin-6-one CAS Name: 3-(3-fluorophenyl)-5-[(phenethylamino)methyl]-1-phenyl-2H-pyrazolo[3,4-b]pyridin-6-one IUPAC Name: 3-(3-fluorophenyl)-5-[(phenethylamino)methyl]-1-phenyl-2H-pyrazolo[3,4-b]pyridin-6-one Traditional Name: 3-(3-fluorophenyl)-5-[(phenethylamino)methyl]-1-phenyl-2H-pyrazolo[3,4-b]pyridin-6-one Formula: C27H23FN4O MolecularWeight: 438.496123

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNCC2=CC3=C(NN(C3=NC2=O)C4=CC=CC=C4)C5=CC(=CC=C5)F

Isomeric SMILES

C1=CC=C(C=C1)CCNCC2=CC3=C(NN(C3=NC2=O)C4=CC=CC=C4)C5=CC(=CC=C5)F

InChI

InChI=1S/C27H23FN4O/c28-22-11-7-10-20(16-22)25-24-17-21(18-29-15-14-19-8-3-1-4-9-19)27(33)30-26(24)32(31-25)23-12-5-2-6-13-23/h1-13,16-17,29,31H,14-15,18H2