1-ethyl-N-(3-methylsulfanylphenyl)-4-oxidanylidene-6-(trifluoromethyl)quinoline-3-carboxamide

Systemtic Name: 1-ethyl-N-(3-methylsulfanylphenyl)-4-oxidanylidene-6-(trifluoromethyl)quinoline-3-carboxamide Openeye Name: 1-ethyl-N-(3-methylsulfanylphenyl)-4-oxo-6-(trifluoromethyl)quinoline-3-carboxamide CAS Name: 1-ethyl-N-[3-(methylthio)phenyl]-4-oxo-6-(trifluoromethyl)-3-quinolinecarboxamide IUPAC Name: 1-ethyl-N-(3-methylsulfanylphenyl)-4-oxo-6-(trifluoromethyl)quinoline-3-carboxamide Traditional Name: 1-ethyl-4-keto-N-[3-(methylthio)phenyl]-6-(trifluoromethyl)quinoline-3-carboxamide Formula: C20H17F3N2O2S MolecularWeight: 406.42139

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=C1C=CC(=C2)C(F)(F)F)C(=O)NC3=CC(=CC=C3)SC

Isomeric SMILES

CCN1C=C(C(=O)C2=C1C=CC(=C2)C(F)(F)F)C(=O)NC3=CC(=CC=C3)SC

InChI

InChI=1S/C20H17F3N2O2S/c1-3-25-11-16(19(27)24-13-5-4-6-14(10-13)28-2)18(26)15-9-12(20(21,22)23)7-8-17(15)25/h4-11H,3H2,1-2H3,(H,24,27)