5-[4-(4-pentylphenyl)phenyl]pyrimidine-2-carbonitrile

Systemtic Name: 5-[4-(4-pentylphenyl)phenyl]pyrimidine-2-carbonitrile Openeye Name: 5-[4-(4-pentylphenyl)phenyl]pyrimidine-2-carbonitrile CAS Name: 5-[4-(4-pentylphenyl)phenyl]-2-pyrimidinecarbonitrile IUPAC Name: 5-[4-(4-pentylphenyl)phenyl]pyrimidine-2-carbonitrile Traditional Name: 5-[4-(4-amylphenyl)phenyl]pyrimidine-2-carbonitrile Formula: C22H21N3 MolecularWeight: 327.42224

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C3=CN=C(N=C3)C#N

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C2=CC=C(C=C2)C3=CN=C(N=C3)C#N

InChI

InChI=1S/C22H21N3/c1-2-3-4-5-17-6-8-18(9-7-17)19-10-12-20(13-11-19)21-15-24-22(14-23)25-16-21/h6-13,15-16H,2-5H2,1H3