methyl 6-methyl-4-oxidanylidene-2-[2-oxidanylidene-2-[[2-(trifluoromethyl)phenyl]amino]ethyl]sulfanyl-1H-quinoline-3-carboxylate

Systemtic Name: methyl 6-methyl-4-oxidanylidene-2-[2-oxidanylidene-2-[[2-(trifluoromethyl)phenyl]amino]ethyl]sulfanyl-1H-quinoline-3-carboxylate Openeye Name: methyl 6-methyl-4-oxo-2-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]sulfanyl-1H-quinoline-3-carboxylate CAS Name: 6-methyl-4-oxo-2-[[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]thio]-1H-quinoline-3-carboxylic acid methyl ester IUPAC Name: methyl 6-methyl-4-oxo-2-[2-oxo-2-[2-(trifluoromethyl)anilino]ethyl]sulfanyl-1H-quinoline-3-carboxylate Traditional Name: 4-keto-2-[[2-keto-2-[2-(trifluoromethyl)anilino]ethyl]thio]-6-methyl-1H-quinoline-3-carboxylic acid methyl ester Formula: C21H17F3N2O4S MolecularWeight: 450.43089

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)NC(=C(C2=O)C(=O)OC)SCC(=O)NC3=CC=CC=C3C(F)(F)F

Isomeric SMILES

CC1=CC2=C(C=C1)NC(=C(C2=O)C(=O)OC)SCC(=O)NC3=CC=CC=C3C(F)(F)F

InChI

InChI=1S/C21H17F3N2O4S/c1-11-7-8-14-12(9-11)18(28)17(20(29)30-2)19(26-14)31-10-16(27)25-15-6-4-3-5-13(15)21(22,23)24/h3-9H,10H2,1-2H3,(H,25,27)(H,26,28)