2-methyl-2-[3-(phenylcarbonyl)-5-(1H-pyrazolo[3,4-b]pyridin-4-yl)phenyl]propanenitrile

Systemtic Name: 2-methyl-2-[3-(phenylcarbonyl)-5-(1H-pyrazolo[3,4-b]pyridin-4-yl)phenyl]propanenitrile Openeye Name: 2-[3-benzoyl-5-(1H-pyrazolo[3,4-b]pyridin-4-yl)phenyl]-2-methyl-propanenitrile CAS Name: 2-[3-benzoyl-5-(1H-pyrazolo[3,4-b]pyridin-4-yl)phenyl]-2-methylpropanenitrile IUPAC Name: 2-[3-benzoyl-5-(1H-pyrazolo[3,4-b]pyridin-4-yl)phenyl]-2-methylpropanenitrile Traditional Name: 2-[3-benzoyl-5-(1H-pyrazolo[3,4-b]pyridin-4-yl)phenyl]-2-methyl-propionitrile Formula: C23H18N4O MolecularWeight: 366.41522

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#N)C1=CC(=CC(=C1)C(=O)C2=CC=CC=C2)C3=C4C=NNC4=NC=C3

Isomeric SMILES

CC(C)(C#N)C1=CC(=CC(=C1)C(=O)C2=CC=CC=C2)C3=C4C=NNC4=NC=C3

InChI

InChI=1S/C23H18N4O/c1-23(2,14-24)18-11-16(19-8-9-25-22-20(19)13-26-27-22)10-17(12-18)21(28)15-6-4-3-5-7-15/h3-13H,1-2H3,(H,25,26,27)