ethyl 2-[3-fluoranyl-4-(trifluoromethyl)phenyl]-1,3-thiazole-4-carboxylate

Systemtic Name: ethyl 2-[3-fluoranyl-4-(trifluoromethyl)phenyl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[3-fluoro-4-(trifluoromethyl)phenyl]thiazole-4-carboxylate CAS Name: 2-[3-fluoro-4-(trifluoromethyl)phenyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[3-fluoro-4-(trifluoromethyl)phenyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[3-fluoro-4-(trifluoromethyl)phenyl]thiazole-4-carboxylic acid ethyl ester Formula: C13H9F4NO2S MolecularWeight: 319.274673

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC(=N1)C2=CC(=C(C=C2)C(F)(F)F)F

Isomeric SMILES

CCOC(=O)C1=CSC(=N1)C2=CC(=C(C=C2)C(F)(F)F)F

InChI

InChI=1S/C13H9F4NO2S/c1-2-20-12(19)10-6-21-11(18-10)7-3-4-8(9(14)5-7)13(15,16)17/h3-6H,2H2,1H3