5-[4-(2-fluoranyl-4-methyl-pentoxy)phenyl]-2-(4-hexylphenyl)pyrimidine

Systemtic Name: 5-[4-(2-fluoranyl-4-methyl-pentoxy)phenyl]-2-(4-hexylphenyl)pyrimidine Openeye Name: 5-[4-(2-fluoro-4-methyl-pentoxy)phenyl]-2-(4-hexylphenyl)pyrimidine CAS Name: 5-[4-(2-fluoro-4-methylpentoxy)phenyl]-2-(4-hexylphenyl)pyrimidine IUPAC Name: 5-[4-(2-fluoro-4-methylpentoxy)phenyl]-2-(4-hexylphenyl)pyrimidine Traditional Name: 5-[4-(2-fluoro-4-methyl-pentoxy)phenyl]-2-(4-hexylphenyl)pyrimidine Formula: C28H35FN2O MolecularWeight: 434.588703

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OCC(CC(C)C)F

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OCC(CC(C)C)F

InChI

InChI=1S/C28H35FN2O/c1-4-5-6-7-8-22-9-11-24(12-10-22)28-30-18-25(19-31-28)23-13-15-27(16-14-23)32-20-26(29)17-21(2)3/h9-16,18-19,21,26H,4-8,17,20H2,1-3H3