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

Systemtic Name: 2-[3-fluoranyl-4-(4-pentylphenyl)phenyl]-5-hexyl-pyrimidine Openeye Name: 2-[3-fluoro-4-(4-pentylphenyl)phenyl]-5-hexyl-pyrimidine CAS Name: 2-[3-fluoro-4-(4-pentylphenyl)phenyl]-5-hexylpyrimidine IUPAC Name: 2-[3-fluoro-4-(4-pentylphenyl)phenyl]-5-hexylpyrimidine Traditional Name: 2-[4-(4-amylphenyl)-3-fluoro-phenyl]-5-hexyl-pyrimidine Formula: C27H33FN2 MolecularWeight: 404.562723

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CN=C(N=C1)C2=CC(=C(C=C2)C3=CC=C(C=C3)CCCCC)F

Isomeric SMILES

CCCCCCC1=CN=C(N=C1)C2=CC(=C(C=C2)C3=CC=C(C=C3)CCCCC)F

InChI

InChI=1S/C27H33FN2/c1-3-5-7-9-11-22-19-29-27(30-20-22)24-16-17-25(26(28)18-24)23-14-12-21(13-15-23)10-8-6-4-2/h12-20H,3-11H2,1-2H3