4-[6-(4-bromophenyl)-2-phenyl-pyrimidin-4-yl]benzenecarbonitrile

Systemtic Name: 4-[6-(4-bromophenyl)-2-phenyl-pyrimidin-4-yl]benzenecarbonitrile Openeye Name: 4-[6-(4-bromophenyl)-2-phenyl-pyrimidin-4-yl]benzonitrile CAS Name: 4-[6-(4-bromophenyl)-2-phenyl-4-pyrimidinyl]benzonitrile IUPAC Name: 4-[6-(4-bromophenyl)-2-phenylpyrimidin-4-yl]benzonitrile Traditional Name: 4-[6-(4-bromophenyl)-2-phenyl-pyrimidin-4-yl]benzonitrile Formula: C23H14BrN3 MolecularWeight: 412.28136

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(=CC(=N2)C3=CC=C(C=C3)Br)C4=CC=C(C=C4)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(=CC(=N2)C3=CC=C(C=C3)Br)C4=CC=C(C=C4)C#N

InChI

InChI=1S/C23H14BrN3/c24-20-12-10-18(11-13-20)22-14-21(17-8-6-16(15-25)7-9-17)26-23(27-22)19-4-2-1-3-5-19/h1-14H