5-butyl-4-fluoranyl-2-[4-(5-pentyl-1,3-dioxan-2-yl)phenyl]pyrimidine

Systemtic Name: 5-butyl-4-fluoranyl-2-[4-(5-pentyl-1,3-dioxan-2-yl)phenyl]pyrimidine Openeye Name: 5-butyl-4-fluoro-2-[4-(5-pentyl-1,3-dioxan-2-yl)phenyl]pyrimidine CAS Name: 5-butyl-4-fluoro-2-[4-(5-pentyl-1,3-dioxan-2-yl)phenyl]pyrimidine IUPAC Name: 5-butyl-4-fluoro-2-[4-(5-pentyl-1,3-dioxan-2-yl)phenyl]pyrimidine Traditional Name: 2-[4-(5-amyl-1,3-dioxan-2-yl)phenyl]-5-butyl-4-fluoro-pyrimidine Formula: C23H31FN2O2 MolecularWeight: 386.502843

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1COC(OC1)C2=CC=C(C=C2)C3=NC=C(C(=N3)F)CCCC

Isomeric SMILES

CCCCCC1COC(OC1)C2=CC=C(C=C2)C3=NC=C(C(=N3)F)CCCC

InChI

InChI=1S/C23H31FN2O2/c1-3-5-7-8-17-15-27-23(28-16-17)19-12-10-18(11-13-19)22-25-14-20(9-6-4-2)21(24)26-22/h10-14,17,23H,3-9,15-16H2,1-2H3