2-[4-[6-(3-chloranyl-4-fluoranyl-phenyl)pyrazin-2-yl]piperazin-1-yl]benzenecarbonitrile

Systemtic Name: 2-[4-[6-(3-chloranyl-4-fluoranyl-phenyl)pyrazin-2-yl]piperazin-1-yl]benzenecarbonitrile Openeye Name: 2-[4-[6-(3-chloro-4-fluoro-phenyl)pyrazin-2-yl]piperazin-1-yl]benzonitrile CAS Name: 2-[4-[6-(3-chloro-4-fluorophenyl)-2-pyrazinyl]-1-piperazinyl]benzonitrile IUPAC Name: 2-[4-[6-(3-chloro-4-fluorophenyl)pyrazin-2-yl]piperazin-1-yl]benzonitrile Traditional Name: 2-[4-[6-(3-chloro-4-fluoro-phenyl)pyrazin-2-yl]piperazino]benzonitrile Formula: C21H17ClFN5 MolecularWeight: 393.844583

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2C#N)C3=NC(=CN=C3)C4=CC(=C(C=C4)F)Cl

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2C#N)C3=NC(=CN=C3)C4=CC(=C(C=C4)F)Cl

InChI

InChI=1S/C21H17ClFN5/c22-17-11-15(5-6-18(17)23)19-13-25-14-21(26-19)28-9-7-27(8-10-28)20-4-2-1-3-16(20)12-24/h1-6,11,13-14H,7-10H2