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

Systemtic Name: 5-[[(4-tert-butylphenyl)amino]methyl]-3-(4-methylphenyl)-1-phenyl-2H-pyrazolo[3,4-b]pyridin-6-one Openeye Name: 5-[(4-tert-butylanilino)methyl]-1-phenyl-3-(p-tolyl)-2H-pyrazolo[3,4-b]pyridin-6-one CAS Name: 5-[(4-tert-butylanilino)methyl]-3-(4-methylphenyl)-1-phenyl-2H-pyrazolo[3,4-b]pyridin-6-one IUPAC Name: 5-[(4-tert-butylanilino)methyl]-3-(4-methylphenyl)-1-phenyl-2H-pyrazolo[3,4-b]pyridin-6-one Traditional Name: 5-[(4-tert-butylanilino)methyl]-1-phenyl-3-(p-tolyl)-2H-pyrazolo[3,4-b]pyridin-6-one Formula: C30H30N4O MolecularWeight: 462.5854

Click to see the large picture

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)C(C)(C)C

Isomeric SMILES

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

InChI

InChI=1S/C30H30N4O/c1-20-10-12-21(13-11-20)27-26-18-22(19-31-24-16-14-23(15-17-24)30(2,3)4)29(35)32-28(26)34(33-27)25-8-6-5-7-9-25/h5-18,31,33H,19H2,1-4H3