2-phenyl-2-(pyrazin-2-ylmethyl)-4-[2-(trifluoromethyl)phenyl]butanenitrile

Systemtic Name: 2-phenyl-2-(pyrazin-2-ylmethyl)-4-[2-(trifluoromethyl)phenyl]butanenitrile Openeye Name: 2-phenyl-2-(pyrazin-2-ylmethyl)-4-[2-(trifluoromethyl)phenyl]butanenitrile CAS Name: 2-phenyl-2-(2-pyrazinylmethyl)-4-[2-(trifluoromethyl)phenyl]butanenitrile IUPAC Name: 2-phenyl-2-(pyrazin-2-ylmethyl)-4-[2-(trifluoromethyl)phenyl]butanenitrile Traditional Name: 2-phenyl-2-(pyrazin-2-ylmethyl)-4-[2-(trifluoromethyl)phenyl]butyronitrile Formula: C22H18F3N3 MolecularWeight: 381.39363

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CCC2=CC=CC=C2C(F)(F)F)(CC3=NC=CN=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)C(CCC2=CC=CC=C2C(F)(F)F)(CC3=NC=CN=C3)C#N

InChI

InChI=1S/C22H18F3N3/c23-22(24,25)20-9-5-4-6-17(20)10-11-21(16-26,18-7-2-1-3-8-18)14-19-15-27-12-13-28-19/h1-9,12-13,15H,10-11,14H2