2-(3-fluoranyl-4-pentyl-phenyl)-5-(4-heptylphenyl)pyrimidine

Systemtic Name: 2-(3-fluoranyl-4-pentyl-phenyl)-5-(4-heptylphenyl)pyrimidine Openeye Name: 2-(3-fluoro-4-pentyl-phenyl)-5-(4-heptylphenyl)pyrimidine CAS Name: 2-(3-fluoro-4-pentylphenyl)-5-(4-heptylphenyl)pyrimidine IUPAC Name: 2-(3-fluoro-4-pentylphenyl)-5-(4-heptylphenyl)pyrimidine Traditional Name: 2-(4-amyl-3-fluoro-phenyl)-5-(4-heptylphenyl)pyrimidine Formula: C28H35FN2 MolecularWeight: 418.589303

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C2=CN=C(N=C2)C3=CC(=C(C=C3)CCCCC)F

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C2=CN=C(N=C2)C3=CC(=C(C=C3)CCCCC)F

InChI

InChI=1S/C28H35FN2/c1-3-5-7-8-10-11-22-13-15-23(16-14-22)26-20-30-28(31-21-26)25-18-17-24(27(29)19-25)12-9-6-4-2/h13-21H,3-12H2,1-2H3