N-ethyl-5-methanethioyl-1-methyl-2-oxidanyl-4-oxidanylidene-N-[4-(trifluoromethyl)phenyl]quinoline-3-carboxamide

Systemtic Name: N-ethyl-5-methanethioyl-1-methyl-2-oxidanyl-4-oxidanylidene-N-[4-(trifluoromethyl)phenyl]quinoline-3-carboxamide Openeye Name: N-ethyl-2-hydroxy-5-methanethioyl-1-methyl-4-oxo-N-[4-(trifluoromethyl)phenyl]quinoline-3-carboxamide CAS Name: N-ethyl-2-hydroxy-5-methanethioyl-1-methyl-4-oxo-N-[4-(trifluoromethyl)phenyl]-3-quinolinecarboxamide IUPAC Name: N-ethyl-2-hydroxy-5-methanethioyl-1-methyl-4-oxo-N-[4-(trifluoromethyl)phenyl]quinoline-3-carboxamide Traditional Name: N-ethyl-2-hydroxy-4-keto-1-methyl-5-thioformyl-N-[4-(trifluoromethyl)phenyl]quinoline-3-carboxamide Formula: C21H17F3N2O3S MolecularWeight: 434.43149

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1=CC=C(C=C1)C(F)(F)F)C(=O)C2=C(N(C3=CC=CC(=C3C2=O)C=S)C)O

Isomeric SMILES

CCN(C1=CC=C(C=C1)C(F)(F)F)C(=O)C2=C(N(C3=CC=CC(=C3C2=O)C=S)C)O

InChI

InChI=1S/C21H17F3N2O3S/c1-3-26(14-9-7-13(8-10-14)21(22,23)24)20(29)17-18(27)16-12(11-30)5-4-6-15(16)25(2)19(17)28/h4-11,28H,3H2,1-2H3