2-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-5-octyl-pyrimidine

Systemtic Name: 2-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-5-octyl-pyrimidine Openeye Name: 2-[4-(difluoromethylsulfanyl)phenyl]-5-octyl-pyrimidine CAS Name: 2-[4-(difluoromethylthio)phenyl]-5-octylpyrimidine IUPAC Name: 2-[4-(difluoromethylsulfanyl)phenyl]-5-octylpyrimidine Traditional Name: 2-[4-(difluoromethylthio)phenyl]-5-octyl-pyrimidine Formula: C19H24F2N2S MolecularWeight: 350.469066

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)SC(F)F

Isomeric SMILES

CCCCCCCCC1=CN=C(N=C1)C2=CC=C(C=C2)SC(F)F

InChI

InChI=1S/C19H24F2N2S/c1-2-3-4-5-6-7-8-15-13-22-18(23-14-15)16-9-11-17(12-10-16)24-19(20)21/h9-14,19H,2-8H2,1H3