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

Systemtic Name: 3-tert-butyl-5-[[(4-methylphenyl)methylamino]methyl]-1-phenyl-2H-pyrazolo[3,4-b]pyridin-6-one Openeye Name: 3-tert-butyl-1-phenyl-5-[(p-tolylmethylamino)methyl]-2H-pyrazolo[3,4-b]pyridin-6-one CAS Name: 3-tert-butyl-5-[[(4-methylphenyl)methylamino]methyl]-1-phenyl-2H-pyrazolo[3,4-b]pyridin-6-one IUPAC Name: 3-tert-butyl-5-[[(4-methylphenyl)methylamino]methyl]-1-phenyl-2H-pyrazolo[3,4-b]pyridin-6-one Traditional Name: 3-tert-butyl-5-[[(4-methylbenzyl)amino]methyl]-1-phenyl-2H-pyrazolo[3,4-b]pyridin-6-one Formula: C25H28N4O MolecularWeight: 400.51602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNCC2=CC3=C(NN(C3=NC2=O)C4=CC=CC=C4)C(C)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)CNCC2=CC3=C(NN(C3=NC2=O)C4=CC=CC=C4)C(C)(C)C

InChI

InChI=1S/C25H28N4O/c1-17-10-12-18(13-11-17)15-26-16-19-14-21-22(25(2,3)4)28-29(23(21)27-24(19)30)20-8-6-5-7-9-20/h5-14,26,28H,15-16H2,1-4H3