5-[4-(2-fluoranyl-3-methyl-butoxy)phenyl]-2-(4-pentylphenyl)pyrimidine

Systemtic Name: 5-[4-(2-fluoranyl-3-methyl-butoxy)phenyl]-2-(4-pentylphenyl)pyrimidine Openeye Name: 5-[4-(2-fluoro-3-methyl-butoxy)phenyl]-2-(4-pentylphenyl)pyrimidine CAS Name: 5-[4-(2-fluoro-3-methylbutoxy)phenyl]-2-(4-pentylphenyl)pyrimidine IUPAC Name: 5-[4-(2-fluoro-3-methylbutoxy)phenyl]-2-(4-pentylphenyl)pyrimidine Traditional Name: 2-(4-amylphenyl)-5-[4-(2-fluoro-3-methyl-butoxy)phenyl]pyrimidine Formula: C26H31FN2O MolecularWeight: 406.535543

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OCC(C(C)C)F

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OCC(C(C)C)F

InChI

InChI=1S/C26H31FN2O/c1-4-5-6-7-20-8-10-22(11-9-20)26-28-16-23(17-29-26)21-12-14-24(15-13-21)30-18-25(27)19(2)3/h8-17,19,25H,4-7,18H2,1-3H3