2-[2,3-bis(fluoranyl)-4-(4-fluoranylpentyl)phenyl]-5-decoxy-pyrimidine

Systemtic Name: 2-[2,3-bis(fluoranyl)-4-(4-fluoranylpentyl)phenyl]-5-decoxy-pyrimidine Openeye Name: 5-decoxy-2-[2,3-difluoro-4-(4-fluoropentyl)phenyl]pyrimidine CAS Name: 5-decoxy-2-[2,3-difluoro-4-(4-fluoropentyl)phenyl]pyrimidine IUPAC Name: 5-decoxy-2-[2,3-difluoro-4-(4-fluoropentyl)phenyl]pyrimidine Traditional Name: 5-decoxy-2-[2,3-difluoro-4-(4-fluoropentyl)phenyl]pyrimidine Formula: C25H35F3N2O MolecularWeight: 436.55341

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CN=C(N=C1)C2=C(C(=C(C=C2)CCCC(C)F)F)F

Isomeric SMILES

CCCCCCCCCCOC1=CN=C(N=C1)C2=C(C(=C(C=C2)CCCC(C)F)F)F

InChI

InChI=1S/C25H35F3N2O/c1-3-4-5-6-7-8-9-10-16-31-21-17-29-25(30-18-21)22-15-14-20(23(27)24(22)28)13-11-12-19(2)26/h14-15,17-19H,3-13,16H2,1-2H3