1-ethyl-4-oxidanylidene-N-(2-phenylsulfanylphenyl)-6-(trifluoromethyl)quinoline-3-carboxamide

Systemtic Name: 1-ethyl-4-oxidanylidene-N-(2-phenylsulfanylphenyl)-6-(trifluoromethyl)quinoline-3-carboxamide Openeye Name: 1-ethyl-4-oxo-N-(2-phenylsulfanylphenyl)-6-(trifluoromethyl)quinoline-3-carboxamide CAS Name: 1-ethyl-4-oxo-N-[2-(phenylthio)phenyl]-6-(trifluoromethyl)-3-quinolinecarboxamide IUPAC Name: 1-ethyl-4-oxo-N-(2-phenylsulfanylphenyl)-6-(trifluoromethyl)quinoline-3-carboxamide Traditional Name: 1-ethyl-4-keto-N-[2-(phenylthio)phenyl]-6-(trifluoromethyl)quinoline-3-carboxamide Formula: C25H19F3N2O2S MolecularWeight: 468.49077

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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=C3SC4=CC=CC=C4

Isomeric SMILES

CCN1C=C(C(=O)C2=C1C=CC(=C2)C(F)(F)F)C(=O)NC3=CC=CC=C3SC4=CC=CC=C4

InChI

InChI=1S/C25H19F3N2O2S/c1-2-30-15-19(23(31)18-14-16(25(26,27)28)12-13-21(18)30)24(32)29-20-10-6-7-11-22(20)33-17-8-4-3-5-9-17/h3-15H,2H2,1H3,(H,29,32)