2-[3-fluoranyl-4-(4-pentylphenyl)phenyl]-5-heptyl-pyrimidine

Systemtic Name: 2-[3-fluoranyl-4-(4-pentylphenyl)phenyl]-5-heptyl-pyrimidine Openeye Name: 2-[3-fluoro-4-(4-pentylphenyl)phenyl]-5-heptyl-pyrimidine CAS Name: 2-[3-fluoro-4-(4-pentylphenyl)phenyl]-5-heptylpyrimidine IUPAC Name: 2-[3-fluoro-4-(4-pentylphenyl)phenyl]-5-heptylpyrimidine Traditional Name: 2-[4-(4-amylphenyl)-3-fluoro-phenyl]-5-heptyl-pyrimidine Formula: C28H35FN2 MolecularWeight: 418.589303

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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