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

Systemtic Name: 2-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-5-ethyl-pyrimidine Openeye Name: 2-[4-(difluoromethylsulfanyl)phenyl]-5-ethyl-pyrimidine CAS Name: 2-[4-(difluoromethylthio)phenyl]-5-ethylpyrimidine IUPAC Name: 2-[4-(difluoromethylsulfanyl)phenyl]-5-ethylpyrimidine Traditional Name: 2-[4-(difluoromethylthio)phenyl]-5-ethyl-pyrimidine Formula: C13H12F2N2S MolecularWeight: 266.309586

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CN=C(N=C1)C2=CC=C(C=C2)SC(F)F

Isomeric SMILES

CCC1=CN=C(N=C1)C2=CC=C(C=C2)SC(F)F

InChI

InChI=1S/C13H12F2N2S/c1-2-9-7-16-12(17-8-9)10-3-5-11(6-4-10)18-13(14)15/h3-8,13H,2H2,1H3