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

Systemtic Name: 2-(3-fluoranyl-4-octyl-phenyl)-5-(4-octylcyclohexyl)pyrimidine Openeye Name: 2-(3-fluoro-4-octyl-phenyl)-5-(4-octylcyclohexyl)pyrimidine CAS Name: 2-(3-fluoro-4-octylphenyl)-5-(4-octylcyclohexyl)pyrimidine IUPAC Name: 2-(3-fluoro-4-octylphenyl)-5-(4-octylcyclohexyl)pyrimidine Traditional Name: 2-(3-fluoro-4-octyl-phenyl)-5-(4-octylcyclohexyl)pyrimidine Formula: C32H49FN2 MolecularWeight: 480.743263

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1CCC(CC1)C2=CN=C(N=C2)C3=CC(=C(C=C3)CCCCCCCC)F

Isomeric SMILES

CCCCCCCCC1CCC(CC1)C2=CN=C(N=C2)C3=CC(=C(C=C3)CCCCCCCC)F

InChI

InChI=1S/C32H49FN2/c1-3-5-7-9-11-13-15-26-17-19-27(20-18-26)30-24-34-32(35-25-30)29-22-21-28(31(33)23-29)16-14-12-10-8-6-4-2/h21-27H,3-20H2,1-2H3