2-(4,6-dimethyl-3-pyrrol-1-yl-pyrazolo[3,4-b]pyridin-1-yl)ethanenitrile

Systemtic Name: 2-(4,6-dimethyl-3-pyrrol-1-yl-pyrazolo[3,4-b]pyridin-1-yl)ethanenitrile Openeye Name: 2-(4,6-dimethyl-3-pyrrol-1-yl-pyrazolo[3,4-b]pyridin-1-yl)acetonitrile CAS Name: 2-[4,6-dimethyl-3-(1-pyrrolyl)-1-pyrazolo[3,4-b]pyridinyl]acetonitrile IUPAC Name: 2-(4,6-dimethyl-3-pyrrol-1-ylpyrazolo[3,4-b]pyridin-1-yl)acetonitrile Traditional Name: 2-(4,6-dimethyl-3-pyrrol-1-yl-pyrazolo[3,4-b]pyridin-1-yl)acetonitrile Formula: C14H13N5 MolecularWeight: 251.28652

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC2=C1C(=NN2CC#N)N3C=CC=C3)C

Isomeric SMILES

CC1=CC(=NC2=C1C(=NN2CC#N)N3C=CC=C3)C

InChI

InChI=1S/C14H13N5/c1-10-9-11(2)16-13-12(10)14(17-19(13)8-5-15)18-6-3-4-7-18/h3-4,6-7,9H,8H2,1-2H3