2-[3-fluoranyl-4-(4-octylcyclohexyl)phenyl]-5-hexyl-pyrimidine

Systemtic Name: 2-[3-fluoranyl-4-(4-octylcyclohexyl)phenyl]-5-hexyl-pyrimidine Openeye Name: 2-[3-fluoro-4-(4-octylcyclohexyl)phenyl]-5-hexyl-pyrimidine CAS Name: 2-[3-fluoro-4-(4-octylcyclohexyl)phenyl]-5-hexylpyrimidine IUPAC Name: 2-[3-fluoro-4-(4-octylcyclohexyl)phenyl]-5-hexylpyrimidine Traditional Name: 2-[3-fluoro-4-(4-octylcyclohexyl)phenyl]-5-hexyl-pyrimidine Formula: C30H45FN2 MolecularWeight: 452.690103

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1CCC(CC1)C2=C(C=C(C=C2)C3=NC=C(C=N3)CCCCCC)F

Isomeric SMILES

CCCCCCCCC1CCC(CC1)C2=C(C=C(C=C2)C3=NC=C(C=N3)CCCCCC)F

InChI

InChI=1S/C30H45FN2/c1-3-5-7-9-10-12-13-24-15-17-26(18-16-24)28-20-19-27(21-29(28)31)30-32-22-25(23-33-30)14-11-8-6-4-2/h19-24,26H,3-18H2,1-2H3