3-[3-[methyl(1H-pyrrolo[2,3-b]pyridin-4-yl)amino]piperidin-1-yl]-3-oxidanylidene-propanenitrile

Systemtic Name: 3-[3-[methyl(1H-pyrrolo[2,3-b]pyridin-4-yl)amino]piperidin-1-yl]-3-oxidanylidene-propanenitrile Openeye Name: 3-[3-[methyl(1H-pyrrolo[2,3-b]pyridin-4-yl)amino]-1-piperidyl]-3-oxo-propanenitrile CAS Name: 3-[3-[methyl(1H-pyrrolo[2,3-b]pyridin-4-yl)amino]-1-piperidinyl]-3-oxopropanenitrile IUPAC Name: 3-[3-[methyl(1H-pyrrolo[2,3-b]pyridin-4-yl)amino]piperidin-1-yl]-3-oxopropanenitrile Traditional Name: 3-keto-3-[3-[methyl(1H-pyrrolo[2,3-b]pyridin-4-yl)amino]piperidino]propionitrile Formula: C16H19N5O MolecularWeight: 297.35496

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCN(C1)C(=O)CC#N)C2=C3C=CNC3=NC=C2

Isomeric SMILES

CN(C1CCCN(C1)C(=O)CC#N)C2=C3C=CNC3=NC=C2

InChI

InChI=1S/C16H19N5O/c1-20(14-6-9-19-16-13(14)5-8-18-16)12-3-2-10-21(11-12)15(22)4-7-17/h5-6,8-9,12H,2-4,10-11H2,1H3,(H,18,19)