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

Systemtic Name: 5-[4-(2-fluoranyl-4-methyl-pentoxy)phenyl]-2-(4-pentoxyphenyl)pyrimidine Openeye Name: 5-[4-(2-fluoro-4-methyl-pentoxy)phenyl]-2-(4-pentoxyphenyl)pyrimidine CAS Name: 5-[4-(2-fluoro-4-methylpentoxy)phenyl]-2-(4-pentoxyphenyl)pyrimidine IUPAC Name: 5-[4-(2-fluoro-4-methylpentoxy)phenyl]-2-(4-pentoxyphenyl)pyrimidine Traditional Name: 2-(4-amoxyphenyl)-5-[4-(2-fluoro-4-methyl-pentoxy)phenyl]pyrimidine Formula: C27H33FN2O2 MolecularWeight: 436.561523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OCC(CC(C)C)F

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C2=NC=C(C=N2)C3=CC=C(C=C3)OCC(CC(C)C)F

InChI

InChI=1S/C27H33FN2O2/c1-4-5-6-15-31-25-13-9-22(10-14-25)27-29-17-23(18-30-27)21-7-11-26(12-8-21)32-19-24(28)16-20(2)3/h7-14,17-18,20,24H,4-6,15-16,19H2,1-3H3