3-fluoranyl-4-[(4-pyrazin-2-ylpiperazin-1-yl)methyl]benzenecarbonitrile

Systemtic Name: 3-fluoranyl-4-[(4-pyrazin-2-ylpiperazin-1-yl)methyl]benzenecarbonitrile Openeye Name: 3-fluoro-4-[(4-pyrazin-2-ylpiperazin-1-yl)methyl]benzonitrile CAS Name: 3-fluoro-4-[[4-(2-pyrazinyl)-1-piperazinyl]methyl]benzonitrile IUPAC Name: 3-fluoro-4-[(4-pyrazin-2-ylpiperazin-1-yl)methyl]benzonitrile Traditional Name: 3-fluoro-4-[(4-pyrazin-2-ylpiperazino)methyl]benzonitrile Formula: C16H16FN5 MolecularWeight: 297.330143

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=C(C=C(C=C2)C#N)F)C3=NC=CN=C3

Isomeric SMILES

C1CN(CCN1CC2=C(C=C(C=C2)C#N)F)C3=NC=CN=C3

InChI

InChI=1S/C16H16FN5/c17-15-9-13(10-18)1-2-14(15)12-21-5-7-22(8-6-21)16-11-19-3-4-20-16/h1-4,9,11H,5-8,12H2