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

Systemtic Name: 2-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-5-decoxy-pyrimidine Openeye Name: 5-decoxy-2-[4-(difluoromethylsulfanyl)phenyl]pyrimidine CAS Name: 5-decoxy-2-[4-(difluoromethylthio)phenyl]pyrimidine IUPAC Name: 5-decoxy-2-[4-(difluoromethylsulfanyl)phenyl]pyrimidine Traditional Name: 5-decoxy-2-[4-(difluoromethylthio)phenyl]pyrimidine Formula: C21H28F2N2OS MolecularWeight: 394.521626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)SC(F)F

Isomeric SMILES

CCCCCCCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)SC(F)F

InChI

InChI=1S/C21H28F2N2OS/c1-2-3-4-5-6-7-8-9-14-26-18-15-24-20(25-16-18)17-10-12-19(13-11-17)27-21(22)23/h10-13,15-16,21H,2-9,14H2,1H3