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

Systemtic Name: 5-[4-(2-fluoranyl-3-methyl-butoxy)phenyl]-2-(4-heptylphenyl)pyrimidine Openeye Name: 5-[4-(2-fluoro-3-methyl-butoxy)phenyl]-2-(4-heptylphenyl)pyrimidine CAS Name: 5-[4-(2-fluoro-3-methylbutoxy)phenyl]-2-(4-heptylphenyl)pyrimidine IUPAC Name: 5-[4-(2-fluoro-3-methylbutoxy)phenyl]-2-(4-heptylphenyl)pyrimidine Traditional Name: 5-[4-(2-fluoro-3-methyl-butoxy)phenyl]-2-(4-heptylphenyl)pyrimidine Formula: C28H35FN2O MolecularWeight: 434.588703

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OCC(C(C)C)F

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OCC(C(C)C)F

InChI

InChI=1S/C28H35FN2O/c1-4-5-6-7-8-9-22-10-12-24(13-11-22)28-30-18-25(19-31-28)23-14-16-26(17-15-23)32-20-27(29)21(2)3/h10-19,21,27H,4-9,20H2,1-3H3