2-[3-fluoranyl-4-(4-heptylphenyl)phenyl]-5-hexyl-pyrimidine

Systemtic Name: 2-[3-fluoranyl-4-(4-heptylphenyl)phenyl]-5-hexyl-pyrimidine Openeye Name: 2-[3-fluoro-4-(4-heptylphenyl)phenyl]-5-hexyl-pyrimidine CAS Name: 2-[3-fluoro-4-(4-heptylphenyl)phenyl]-5-hexylpyrimidine IUPAC Name: 2-[3-fluoro-4-(4-heptylphenyl)phenyl]-5-hexylpyrimidine Traditional Name: 2-[3-fluoro-4-(4-heptylphenyl)phenyl]-5-hexyl-pyrimidine Formula: C29H37FN2 MolecularWeight: 432.615883

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C2=C(C=C(C=C2)C3=NC=C(C=N3)CCCCCC)F

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C2=C(C=C(C=C2)C3=NC=C(C=N3)CCCCCC)F

InChI

InChI=1S/C29H37FN2/c1-3-5-7-9-11-12-23-14-16-25(17-15-23)27-19-18-26(20-28(27)30)29-31-21-24(22-32-29)13-10-8-6-4-2/h14-22H,3-13H2,1-2H3