ethyl 4-chloranyl-2-methylsulfanyl-8-(trifluoromethyl)quinoline-3-carboxylate

Systemtic Name: ethyl 4-chloranyl-2-methylsulfanyl-8-(trifluoromethyl)quinoline-3-carboxylate Openeye Name: ethyl 4-chloro-2-methylsulfanyl-8-(trifluoromethyl)quinoline-3-carboxylate CAS Name: 4-chloro-2-(methylthio)-8-(trifluoromethyl)-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-chloro-2-methylsulfanyl-8-(trifluoromethyl)quinoline-3-carboxylate Traditional Name: 4-chloro-2-(methylthio)-8-(trifluoromethyl)quinoline-3-carboxylic acid ethyl ester Formula: C14H11ClF3NO2S MolecularWeight: 349.75585

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C(=CC=C2)C(F)(F)F)N=C1SC)Cl

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C(=CC=C2)C(F)(F)F)N=C1SC)Cl

InChI

InChI=1S/C14H11ClF3NO2S/c1-3-21-13(20)9-10(15)7-5-4-6-8(14(16,17)18)11(7)19-12(9)22-2/h4-6H,3H2,1-2H3