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

Systemtic Name: 2-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-5-pentoxy-pyrimidine Openeye Name: 2-[4-(difluoromethylsulfanyl)phenyl]-5-pentoxy-pyrimidine CAS Name: 2-[4-(difluoromethylthio)phenyl]-5-pentoxypyrimidine IUPAC Name: 2-[4-(difluoromethylsulfanyl)phenyl]-5-pentoxypyrimidine Traditional Name: 5-amoxy-2-[4-(difluoromethylthio)phenyl]pyrimidine Formula: C16H18F2N2OS MolecularWeight: 324.388726

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)SC(F)F

Isomeric SMILES

CCCCCOC1=CN=C(N=C1)C2=CC=C(C=C2)SC(F)F

InChI

InChI=1S/C16H18F2N2OS/c1-2-3-4-9-21-13-10-19-15(20-11-13)12-5-7-14(8-6-12)22-16(17)18/h5-8,10-11,16H,2-4,9H2,1H3