(2E)-2-[[2-ethylsulfonyl-5-(trifluoromethyl)phenyl]hydrazinylidene]-3-oxidanylidene-butanenitrile

Systemtic Name: (2E)-2-[[2-ethylsulfonyl-5-(trifluoromethyl)phenyl]hydrazinylidene]-3-oxidanylidene-butanenitrile Openeye Name: (1E)-N-[2-ethylsulfonyl-5-(trifluoromethyl)anilino]-2-oxo-propanimidoyl cyanide CAS Name: (2E)-2-[[2-ethylsulfonyl-5-(trifluoromethyl)phenyl]hydrazinylidene]-3-oxobutanenitrile IUPAC Name: (1E)-N-[2-ethylsulfonyl-5-(trifluoromethyl)anilino]-2-oxopropanimidoyl cyanide Traditional Name: (2E)-2-[[2-esyl-5-(trifluoromethyl)phenyl]hydrazono]-3-keto-butyronitrile Formula: C13H12F3N3O3S MolecularWeight: 347.31289

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=C(C=C(C=C1)C(F)(F)F)NN=C(C#N)C(=O)C

Isomeric SMILES

CCS(=O)(=O)C1=C(C=C(C=C1)C(F)(F)F)N/N=C(\C#N)/C(=O)C

InChI

InChI=1S/C13H12F3N3O3S/c1-3-23(21,22)12-5-4-9(13(14,15)16)6-10(12)18-19-11(7-17)8(2)20/h4-6,18H,3H2,1-2H3/b19-11+