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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CN=C(N=C1)CCC2=C(C(=CC=C2)F)OCCCC

Isomeric SMILES

CCCCCC1=CN=C(N=C1)CCC2=C(C(=CC=C2)F)OCCCC

InChI

InChI=1S/C21H29FN2O/c1-3-5-7-9-17-15-23-20(24-16-17)13-12-18-10-8-11-19(22)21(18)25-14-6-4-2/h8,10-11,15-16H,3-7,9,12-14H2,1-2H3