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

Systemtic Name: 5-[4-(2-fluoranyl-4-methyl-pentoxy)phenyl]-2-(4-pentylphenyl)pyrimidine Openeye Name: 5-[4-(2-fluoro-4-methyl-pentoxy)phenyl]-2-(4-pentylphenyl)pyrimidine CAS Name: 5-[4-(2-fluoro-4-methylpentoxy)phenyl]-2-(4-pentylphenyl)pyrimidine IUPAC Name: 5-[4-(2-fluoro-4-methylpentoxy)phenyl]-2-(4-pentylphenyl)pyrimidine Traditional Name: 2-(4-amylphenyl)-5-[4-(2-fluoro-4-methyl-pentoxy)phenyl]pyrimidine Formula: C27H33FN2O MolecularWeight: 420.562123

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H33FN2O/c1-4-5-6-7-21-8-10-23(11-9-21)27-29-17-24(18-30-27)22-12-14-26(15-13-22)31-19-25(28)16-20(2)3/h8-15,17-18,20,25H,4-7,16,19H2,1-3H3