5-buta-1,3-diynoxy-2-[4-(2-fluoranyl-2-methyl-heptoxy)phenyl]pyrimidine

Systemtic Name: 5-buta-1,3-diynoxy-2-[4-(2-fluoranyl-2-methyl-heptoxy)phenyl]pyrimidine Openeye Name: 5-buta-1,3-diynoxy-2-[4-(2-fluoro-2-methyl-heptoxy)phenyl]pyrimidine CAS Name: 5-buta-1,3-diynoxy-2-[4-(2-fluoro-2-methylheptoxy)phenyl]pyrimidine IUPAC Name: 5-buta-1,3-diynoxy-2-[4-(2-fluoro-2-methylheptoxy)phenyl]pyrimidine Traditional Name: 5-buta-1,3-diynoxy-2-[4-(2-fluoro-2-methyl-heptoxy)phenyl]pyrimidine Formula: C22H23FN2O2 MolecularWeight: 366.428623

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)(COC1=CC=C(C=C1)C2=NC=C(C=N2)OC#CC#C)F

Isomeric SMILES

CCCCCC(C)(COC1=CC=C(C=C1)C2=NC=C(C=N2)OC#CC#C)F

InChI

InChI=1S/C22H23FN2O2/c1-4-6-8-13-22(3,23)17-27-19-11-9-18(10-12-19)21-24-15-20(16-25-21)26-14-7-5-2/h2,9-12,15-16H,4,6,8,13,17H2,1,3H3