5-[2-(4-butoxy-3-fluoranyl-phenyl)ethyl]-2-pentyl-pyrimidine

Systemtic Name: 5-[2-(4-butoxy-3-fluoranyl-phenyl)ethyl]-2-pentyl-pyrimidine Openeye Name: 5-[2-(4-butoxy-3-fluoro-phenyl)ethyl]-2-pentyl-pyrimidine CAS Name: 5-[2-(4-butoxy-3-fluorophenyl)ethyl]-2-pentylpyrimidine IUPAC Name: 5-[2-(4-butoxy-3-fluorophenyl)ethyl]-2-pentylpyrimidine Traditional Name: 2-amyl-5-[2-(4-butoxy-3-fluoro-phenyl)ethyl]pyrimidine Formula: C21H29FN2O MolecularWeight: 344.466163

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=NC=C(C=N1)CCC2=CC(=C(C=C2)OCCCC)F

Isomeric SMILES

CCCCCC1=NC=C(C=N1)CCC2=CC(=C(C=C2)OCCCC)F

InChI

InChI=1S/C21H29FN2O/c1-3-5-7-8-21-23-15-18(16-24-21)10-9-17-11-12-20(19(22)14-17)25-13-6-4-2/h11-12,14-16H,3-10,13H2,1-2H3