2-(3-fluoranyl-4-octyl-phenyl)-5-(4-pentylcyclohexyl)pyrimidine

Systemtic Name: 2-(3-fluoranyl-4-octyl-phenyl)-5-(4-pentylcyclohexyl)pyrimidine Openeye Name: 2-(3-fluoro-4-octyl-phenyl)-5-(4-pentylcyclohexyl)pyrimidine CAS Name: 2-(3-fluoro-4-octylphenyl)-5-(4-pentylcyclohexyl)pyrimidine IUPAC Name: 2-(3-fluoro-4-octylphenyl)-5-(4-pentylcyclohexyl)pyrimidine Traditional Name: 5-(4-amylcyclohexyl)-2-(3-fluoro-4-octyl-phenyl)pyrimidine Formula: C29H43FN2 MolecularWeight: 438.663523

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=C(C=C(C=C1)C2=NC=C(C=N2)C3CCC(CC3)CCCCC)F

Isomeric SMILES

CCCCCCCCC1=C(C=C(C=C1)C2=NC=C(C=N2)C3CCC(CC3)CCCCC)F

InChI

InChI=1S/C29H43FN2/c1-3-5-7-8-9-11-13-25-18-19-26(20-28(25)30)29-31-21-27(22-32-29)24-16-14-23(15-17-24)12-10-6-4-2/h18-24H,3-17H2,1-2H3