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

Systemtic Name: 3-tert-butyl-5-[[(4-phenoxyphenyl)amino]methyl]-1-phenyl-2H-pyrazolo[3,4-b]pyridin-6-one Openeye Name: 3-tert-butyl-5-[(4-phenoxyanilino)methyl]-1-phenyl-2H-pyrazolo[3,4-b]pyridin-6-one CAS Name: 3-tert-butyl-5-[(4-phenoxyanilino)methyl]-1-phenyl-2H-pyrazolo[3,4-b]pyridin-6-one IUPAC Name: 3-tert-butyl-5-[(4-phenoxyanilino)methyl]-1-phenyl-2H-pyrazolo[3,4-b]pyridin-6-one Traditional Name: 3-tert-butyl-5-[(4-phenoxyanilino)methyl]-1-phenyl-2H-pyrazolo[3,4-b]pyridin-6-one Formula: C29H28N4O2 MolecularWeight: 464.55822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C2C=C(C(=O)N=C2N(N1)C3=CC=CC=C3)CNC4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

CC(C)(C)C1=C2C=C(C(=O)N=C2N(N1)C3=CC=CC=C3)CNC4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C29H28N4O2/c1-29(2,3)26-25-18-20(28(34)31-27(25)33(32-26)22-10-6-4-7-11-22)19-30-21-14-16-24(17-15-21)35-23-12-8-5-9-13-23/h4-18,30,32H,19H2,1-3H3