2-[(4-chlorophenyl)methyl]-2-phenyl-3-pyrimidin-5-yl-propanenitrile

Systemtic Name: 2-[(4-chlorophenyl)methyl]-2-phenyl-3-pyrimidin-5-yl-propanenitrile Openeye Name: 2-[(4-chlorophenyl)methyl]-2-phenyl-3-pyrimidin-5-yl-propanenitrile CAS Name: 2-[(4-chlorophenyl)methyl]-2-phenyl-3-(5-pyrimidinyl)propanenitrile IUPAC Name: 2-[(4-chlorophenyl)methyl]-2-phenyl-3-pyrimidin-5-ylpropanenitrile Traditional Name: 2-(4-chlorobenzyl)-2-phenyl-3-(5-pyrimidyl)propionitrile Formula: C20H16ClN3 MolecularWeight: 333.81414

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC2=CC=C(C=C2)Cl)(CC3=CN=CN=C3)C#N

Isomeric SMILES

C1=CC=C(C=C1)C(CC2=CC=C(C=C2)Cl)(CC3=CN=CN=C3)C#N

InChI

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