3-cyano-4-oxidanylidene-4-[[4-(trifluoromethyl)phenyl]amino]butane-2-thiolate

Systemtic Name: 3-cyano-4-oxidanylidene-4-[[4-(trifluoromethyl)phenyl]amino]butane-2-thiolate Openeye Name: 3-cyano-4-oxo-4-[4-(trifluoromethyl)anilino]butane-2-thiolate CAS Name: 3-cyano-4-oxo-4-[4-(trifluoromethyl)anilino]-2-butanethiolate IUPAC Name: 3-cyano-4-oxo-4-[4-(trifluoromethyl)anilino]butane-2-thiolate Traditional Name: 3-cyano-4-keto-4-[4-(trifluoromethyl)anilino]butane-2-thiolate Formula: C12H10F3N2OS- MolecularWeight: 287.28081

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(C#N)C(=O)NC1=CC=C(C=C1)C(F)(F)F)[S-]

Isomeric SMILES

CC(C(C#N)C(=O)NC1=CC=C(C=C1)C(F)(F)F)[S-]

InChI

InChI=1S/C12H11F3N2OS/c1-7(19)10(6-16)11(18)17-9-4-2-8(3-5-9)12(13,14)15/h2-5,7,10,19H,1H3,(H,17,18)/p-1