3-methylsulfanyl-5-[4-(trifluoromethyloxy)phenyl]-1,2-oxazole-4-carbonitrile

Systemtic Name: 3-methylsulfanyl-5-[4-(trifluoromethyloxy)phenyl]-1,2-oxazole-4-carbonitrile Openeye Name: 3-methylsulfanyl-5-[4-(trifluoromethoxy)phenyl]isoxazole-4-carbonitrile CAS Name: 3-(methylthio)-5-[4-(trifluoromethoxy)phenyl]-4-isoxazolecarbonitrile IUPAC Name: 3-methylsulfanyl-5-[4-(trifluoromethoxy)phenyl]-1,2-oxazole-4-carbonitrile Traditional Name: 3-(methylthio)-5-[4-(trifluoromethoxy)phenyl]isoxazole-4-carbonitrile Formula: C12H7F3N2O2S MolecularWeight: 300.25639

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CSC1=NOC(=C1C#N)C2=CC=C(C=C2)OC(F)(F)F

Isomeric SMILES

CSC1=NOC(=C1C#N)C2=CC=C(C=C2)OC(F)(F)F

InChI

InChI=1S/C12H7F3N2O2S/c1-20-11-9(6-16)10(19-17-11)7-2-4-8(5-3-7)18-12(13,14)15/h2-5H,1H3