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

Systemtic Name: 2-[3-fluoranyl-4-(3-fluoranylbutoxy)phenyl]-5-hexyl-pyrimidine Openeye Name: 2-[3-fluoro-4-(3-fluorobutoxy)phenyl]-5-hexyl-pyrimidine CAS Name: 2-[3-fluoro-4-(3-fluorobutoxy)phenyl]-5-hexylpyrimidine IUPAC Name: 2-[3-fluoro-4-(3-fluorobutoxy)phenyl]-5-hexylpyrimidine Traditional Name: 2-[3-fluoro-4-(3-fluorobutoxy)phenyl]-5-hexyl-pyrimidine Formula: C20H26F2N2O MolecularWeight: 348.430046

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CN=C(N=C1)C2=CC(=C(C=C2)OCCC(C)F)F

Isomeric SMILES

CCCCCCC1=CN=C(N=C1)C2=CC(=C(C=C2)OCCC(C)F)F

InChI

InChI=1S/C20H26F2N2O/c1-3-4-5-6-7-16-13-23-20(24-14-16)17-8-9-19(18(22)12-17)25-11-10-15(2)21/h8-9,12-15H,3-7,10-11H2,1-2H3