2-[4-(pyridin-4-ylmethyl)piperazin-1-yl]pyridine-3-carbonitrile

Systemtic Name: 2-[4-(pyridin-4-ylmethyl)piperazin-1-yl]pyridine-3-carbonitrile Openeye Name: 2-[4-(4-pyridylmethyl)piperazin-1-yl]pyridine-3-carbonitrile CAS Name: 2-[4-(pyridin-4-ylmethyl)-1-piperazinyl]-3-pyridinecarbonitrile IUPAC Name: 2-[4-(pyridin-4-ylmethyl)piperazin-1-yl]pyridine-3-carbonitrile Traditional Name: 2-[4-(4-pyridylmethyl)piperazino]nicotinonitrile Formula: C16H17N5 MolecularWeight: 279.33968

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=NC=C2)C3=C(C=CC=N3)C#N

Isomeric SMILES

C1CN(CCN1CC2=CC=NC=C2)C3=C(C=CC=N3)C#N

InChI

InChI=1S/C16H17N5/c17-12-15-2-1-5-19-16(15)21-10-8-20(9-11-21)13-14-3-6-18-7-4-14/h1-7H,8-11,13H2