ethyl 4,5-dimethyl-2-[[8-(trifluoromethyl)quinolin-4-yl]amino]thiophene-3-carboxylate

Systemtic Name: ethyl 4,5-dimethyl-2-[[8-(trifluoromethyl)quinolin-4-yl]amino]thiophene-3-carboxylate Openeye Name: ethyl 4,5-dimethyl-2-[[8-(trifluoromethyl)-4-quinolyl]amino]thiophene-3-carboxylate CAS Name: 4,5-dimethyl-2-[[8-(trifluoromethyl)-4-quinolinyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4,5-dimethyl-2-[[8-(trifluoromethyl)quinolin-4-yl]amino]thiophene-3-carboxylate Traditional Name: 4,5-dimethyl-2-[[8-(trifluoromethyl)-4-quinolyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C19H17F3N2O2S MolecularWeight: 394.41069

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C)NC2=C3C=CC=C(C3=NC=C2)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C)NC2=C3C=CC=C(C3=NC=C2)C(F)(F)F

InChI

InChI=1S/C19H17F3N2O2S/c1-4-26-18(25)15-10(2)11(3)27-17(15)24-14-8-9-23-16-12(14)6-5-7-13(16)19(20,21)22/h5-9H,4H2,1-3H3,(H,23,24)