3-(4-methylphenyl)-5-[[(4-phenoxyphenyl)amino]methyl]-1-phenyl-2H-pyrazolo[3,4-b]pyridin-6-one

Systemtic Name: 3-(4-methylphenyl)-5-[[(4-phenoxyphenyl)amino]methyl]-1-phenyl-2H-pyrazolo[3,4-b]pyridin-6-one Openeye Name: 5-[(4-phenoxyanilino)methyl]-1-phenyl-3-(p-tolyl)-2H-pyrazolo[3,4-b]pyridin-6-one CAS Name: 3-(4-methylphenyl)-5-[(4-phenoxyanilino)methyl]-1-phenyl-2H-pyrazolo[3,4-b]pyridin-6-one IUPAC Name: 3-(4-methylphenyl)-5-[(4-phenoxyanilino)methyl]-1-phenyl-2H-pyrazolo[3,4-b]pyridin-6-one Traditional Name: 5-[(4-phenoxyanilino)methyl]-1-phenyl-3-(p-tolyl)-2H-pyrazolo[3,4-b]pyridin-6-one Formula: C32H26N4O2 MolecularWeight: 498.57444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C3C=C(C(=O)N=C3N(N2)C4=CC=CC=C4)CNC5=CC=C(C=C5)OC6=CC=CC=C6

Isomeric SMILES

CC1=CC=C(C=C1)C2=C3C=C(C(=O)N=C3N(N2)C4=CC=CC=C4)CNC5=CC=C(C=C5)OC6=CC=CC=C6

InChI

InChI=1S/C32H26N4O2/c1-22-12-14-23(15-13-22)30-29-20-24(32(37)34-31(29)36(35-30)26-8-4-2-5-9-26)21-33-25-16-18-28(19-17-25)38-27-10-6-3-7-11-27/h2-20,33,35H,21H2,1H3