3-[2-(6-chloranylpyrazin-2-yl)ethynyl]-5-fluoranyl-benzenecarbonitrile

Systemtic Name: 3-[2-(6-chloranylpyrazin-2-yl)ethynyl]-5-fluoranyl-benzenecarbonitrile Openeye Name: 3-[2-(6-chloropyrazin-2-yl)ethynyl]-5-fluoro-benzonitrile CAS Name: 3-[2-(6-chloro-2-pyrazinyl)ethynyl]-5-fluorobenzonitrile IUPAC Name: 3-[2-(6-chloropyrazin-2-yl)ethynyl]-5-fluorobenzonitrile Traditional Name: 3-[2-(6-chloropyrazin-2-yl)ethynyl]-5-fluoro-benzonitrile Formula: C13H5ClFN3 MolecularWeight: 257.650303

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1C#N)F)C#CC2=CN=CC(=N2)Cl

Isomeric SMILES

C1=C(C=C(C=C1C#N)F)C#CC2=CN=CC(=N2)Cl

InChI

InChI=1S/C13H5ClFN3/c14-13-8-17-7-12(18-13)2-1-9-3-10(6-16)5-11(15)4-9/h3-5,7-8H