2-phenyl-2-[pyrimidin-5-yl-[4-(trifluoromethyl)phenyl]methyl]butanenitrile

Systemtic Name: 2-phenyl-2-[pyrimidin-5-yl-[4-(trifluoromethyl)phenyl]methyl]butanenitrile Openeye Name: 2-phenyl-2-[pyrimidin-5-yl-[4-(trifluoromethyl)phenyl]methyl]butanenitrile CAS Name: 2-phenyl-2-[5-pyrimidinyl-[4-(trifluoromethyl)phenyl]methyl]butanenitrile IUPAC Name: 2-phenyl-2-[pyrimidin-5-yl-[4-(trifluoromethyl)phenyl]methyl]butanenitrile Traditional Name: 2-phenyl-2-[5-pyrimidyl-[4-(trifluoromethyl)phenyl]methyl]butyronitrile Formula: C22H18F3N3 MolecularWeight: 381.39363

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C#N)(C1=CC=CC=C1)C(C2=CC=C(C=C2)C(F)(F)F)C3=CN=CN=C3

Isomeric SMILES

CCC(C#N)(C1=CC=CC=C1)C(C2=CC=C(C=C2)C(F)(F)F)C3=CN=CN=C3

InChI

InChI=1S/C22H18F3N3/c1-2-21(14-26,18-6-4-3-5-7-18)20(17-12-27-15-28-13-17)16-8-10-19(11-9-16)22(23,24)25/h3-13,15,20H,2H2,1H3