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

Systemtic Name: 2-[3-(3-azanylpropylamino)-5-(1H-pyrazolo[3,4-b]pyridin-4-yl)phenyl]-2-methyl-propanenitrile Openeye Name: 2-[3-(3-aminopropylamino)-5-(1H-pyrazolo[3,4-b]pyridin-4-yl)phenyl]-2-methyl-propanenitrile CAS Name: 2-[3-(3-aminopropylamino)-5-(1H-pyrazolo[3,4-b]pyridin-4-yl)phenyl]-2-methylpropanenitrile IUPAC Name: 2-[3-(3-aminopropylamino)-5-(1H-pyrazolo[3,4-b]pyridin-4-yl)phenyl]-2-methylpropanenitrile Traditional Name: 2-[3-(3-aminopropylamino)-5-(1H-pyrazolo[3,4-b]pyridin-4-yl)phenyl]-2-methyl-propionitrile Formula: C19H22N6 MolecularWeight: 334.41818

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C#N)C1=CC(=CC(=C1)C2=C3C=NNC3=NC=C2)NCCCN

Isomeric SMILES

CC(C)(C#N)C1=CC(=CC(=C1)C2=C3C=NNC3=NC=C2)NCCCN

InChI

InChI=1S/C19H22N6/c1-19(2,12-21)14-8-13(9-15(10-14)22-6-3-5-20)16-4-7-23-18-17(16)11-24-25-18/h4,7-11,22H,3,5-6,20H2,1-2H3,(H,23,24,25)