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

Systemtic Name: 5-[4-(2-fluoranyl-3-methyl-butoxy)phenyl]-2-(4-hexoxyphenyl)pyrimidine Openeye Name: 5-[4-(2-fluoro-3-methyl-butoxy)phenyl]-2-(4-hexoxyphenyl)pyrimidine CAS Name: 5-[4-(2-fluoro-3-methylbutoxy)phenyl]-2-(4-hexoxyphenyl)pyrimidine IUPAC Name: 5-[4-(2-fluoro-3-methylbutoxy)phenyl]-2-(4-hexoxyphenyl)pyrimidine Traditional Name: 5-[4-(2-fluoro-3-methyl-butoxy)phenyl]-2-(4-hexoxyphenyl)pyrimidine Formula: C27H33FN2O2 MolecularWeight: 436.561523

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OCC(C(C)C)F

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OCC(C(C)C)F

InChI

InChI=1S/C27H33FN2O2/c1-4-5-6-7-16-31-24-14-10-22(11-15-24)27-29-17-23(18-30-27)21-8-12-25(13-9-21)32-19-26(28)20(2)3/h8-15,17-18,20,26H,4-7,16,19H2,1-3H3