4-[4-ethyl-5-oxidanylidene-3-(trifluoromethyl)-1,2,4-triazol-1-yl]-2-fluoranyl-benzenecarbonitrile

Systemtic Name: 4-[4-ethyl-5-oxidanylidene-3-(trifluoromethyl)-1,2,4-triazol-1-yl]-2-fluoranyl-benzenecarbonitrile Openeye Name: 4-[4-ethyl-5-oxo-3-(trifluoromethyl)-1,2,4-triazol-1-yl]-2-fluoro-benzonitrile CAS Name: 4-[4-ethyl-5-oxo-3-(trifluoromethyl)-1,2,4-triazol-1-yl]-2-fluorobenzonitrile IUPAC Name: 4-[4-ethyl-5-oxo-3-(trifluoromethyl)-1,2,4-triazol-1-yl]-2-fluorobenzonitrile Traditional Name: 4-[4-ethyl-5-keto-3-(trifluoromethyl)-1,2,4-triazol-1-yl]-2-fluoro-benzonitrile Formula: C12H8F4N4O MolecularWeight: 300.211733

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN(C1=O)C2=CC(=C(C=C2)C#N)F)C(F)(F)F

Isomeric SMILES

CCN1C(=NN(C1=O)C2=CC(=C(C=C2)C#N)F)C(F)(F)F

InChI

InChI=1S/C12H8F4N4O/c1-2-19-10(12(14,15)16)18-20(11(19)21)8-4-3-7(6-17)9(13)5-8/h3-5H,2H2,1H3