5-(2-fluoranyl-4-pentyl-phenyl)-2-heptyl-pyrimidine

Systemtic Name: 5-(2-fluoranyl-4-pentyl-phenyl)-2-heptyl-pyrimidine Openeye Name: 5-(2-fluoro-4-pentyl-phenyl)-2-heptyl-pyrimidine CAS Name: 5-(2-fluoro-4-pentylphenyl)-2-heptylpyrimidine IUPAC Name: 5-(2-fluoro-4-pentylphenyl)-2-heptylpyrimidine Traditional Name: 5-(4-amyl-2-fluoro-phenyl)-2-heptyl-pyrimidine Formula: C22H31FN2 MolecularWeight: 342.493343

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=NC=C(C=N1)C2=C(C=C(C=C2)CCCCC)F

Isomeric SMILES

CCCCCCCC1=NC=C(C=N1)C2=C(C=C(C=C2)CCCCC)F

InChI

InChI=1S/C22H31FN2/c1-3-5-7-8-10-12-22-24-16-19(17-25-22)20-14-13-18(15-21(20)23)11-9-6-4-2/h13-17H,3-12H2,1-2H3