4-(4-chlorophenyl)-2-(3-fluorophenyl)-2-(pyrimidin-5-ylmethyl)butanenitrile

Systemtic Name: 4-(4-chlorophenyl)-2-(3-fluorophenyl)-2-(pyrimidin-5-ylmethyl)butanenitrile Openeye Name: 4-(4-chlorophenyl)-2-(3-fluorophenyl)-2-(pyrimidin-5-ylmethyl)butanenitrile CAS Name: 4-(4-chlorophenyl)-2-(3-fluorophenyl)-2-(5-pyrimidinylmethyl)butanenitrile IUPAC Name: 4-(4-chlorophenyl)-2-(3-fluorophenyl)-2-(pyrimidin-5-ylmethyl)butanenitrile Traditional Name: 4-(4-chlorophenyl)-2-(3-fluorophenyl)-2-(5-pyrimidylmethyl)butyronitrile Formula: C21H17ClFN3 MolecularWeight: 365.831183

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)F)C(CCC2=CC=C(C=C2)Cl)(CC3=CN=CN=C3)C#N

Isomeric SMILES

C1=CC(=CC(=C1)F)C(CCC2=CC=C(C=C2)Cl)(CC3=CN=CN=C3)C#N

InChI

InChI=1S/C21H17ClFN3/c22-19-6-4-16(5-7-19)8-9-21(14-24,11-17-12-25-15-26-13-17)18-2-1-3-20(23)10-18/h1-7,10,12-13,15H,8-9,11H2