4-(4-chlorophenyl)-2-phenyl-2-pyrimidin-5-yl-butanenitrile

Systemtic Name: 4-(4-chlorophenyl)-2-phenyl-2-pyrimidin-5-yl-butanenitrile Openeye Name: 4-(4-chlorophenyl)-2-phenyl-2-pyrimidin-5-yl-butanenitrile CAS Name: 4-(4-chlorophenyl)-2-phenyl-2-(5-pyrimidinyl)butanenitrile IUPAC Name: 4-(4-chlorophenyl)-2-phenyl-2-pyrimidin-5-ylbutanenitrile Traditional Name: 4-(4-chlorophenyl)-2-phenyl-2-(5-pyrimidyl)butyronitrile Formula: C20H16ClN3 MolecularWeight: 333.81414

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H16ClN3/c21-19-8-6-16(7-9-19)10-11-20(14-22,17-4-2-1-3-5-17)18-12-23-15-24-13-18/h1-9,12-13,15H,10-11H2