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

Systemtic Name: ethyl 4-phenyl-2-[[8-(trifluoromethyl)quinolin-4-yl]amino]thiophene-3-carboxylate Openeye Name: ethyl 4-phenyl-2-[[8-(trifluoromethyl)-4-quinolyl]amino]thiophene-3-carboxylate CAS Name: 4-phenyl-2-[[8-(trifluoromethyl)-4-quinolinyl]amino]-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 4-phenyl-2-[[8-(trifluoromethyl)quinolin-4-yl]amino]thiophene-3-carboxylate Traditional Name: 4-phenyl-2-[[8-(trifluoromethyl)-4-quinolyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C23H17F3N2O2S MolecularWeight: 442.45349

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC3=C4C=CC=C(C4=NC=C3)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=C(SC=C1C2=CC=CC=C2)NC3=C4C=CC=C(C4=NC=C3)C(F)(F)F

InChI

InChI=1S/C23H17F3N2O2S/c1-2-30-22(29)19-16(14-7-4-3-5-8-14)13-31-21(19)28-18-11-12-27-20-15(18)9-6-10-17(20)23(24,25)26/h3-13H,2H2,1H3,(H,27,28)