4-[[4-[6-(pyridin-4-ylmethoxy)pyridin-2-yl]piperazin-1-yl]methyl]benzenecarbonitrile

Systemtic Name: 4-[[4-[6-(pyridin-4-ylmethoxy)pyridin-2-yl]piperazin-1-yl]methyl]benzenecarbonitrile Openeye Name: 4-[[4-[6-(4-pyridylmethoxy)-2-pyridyl]piperazin-1-yl]methyl]benzonitrile CAS Name: 4-[[4-[6-(pyridin-4-ylmethoxy)-2-pyridinyl]-1-piperazinyl]methyl]benzonitrile IUPAC Name: 4-[[4-[6-(pyridin-4-ylmethoxy)pyridin-2-yl]piperazin-1-yl]methyl]benzonitrile Traditional Name: 4-[[4-[6-(4-pyridylmethoxy)-2-pyridyl]piperazino]methyl]benzonitrile Formula: C23H23N5O MolecularWeight: 385.46162

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=C(C=C2)C#N)C3=NC(=CC=C3)OCC4=CC=NC=C4

Isomeric SMILES

C1CN(CCN1CC2=CC=C(C=C2)C#N)C3=NC(=CC=C3)OCC4=CC=NC=C4

InChI

InChI=1S/C23H23N5O/c24-16-19-4-6-20(7-5-19)17-27-12-14-28(15-13-27)22-2-1-3-23(26-22)29-18-21-8-10-25-11-9-21/h1-11H,12-15,17-18H2