ethyl 3-[3,5-bis(trifluoromethyl)phenyl]-1,2-thiazole-4-carboxylate

Systemtic Name: ethyl 3-[3,5-bis(trifluoromethyl)phenyl]-1,2-thiazole-4-carboxylate Openeye Name: ethyl 3-[3,5-bis(trifluoromethyl)phenyl]isothiazole-4-carboxylate CAS Name: 3-[3,5-bis(trifluoromethyl)phenyl]-4-isothiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[3,5-bis(trifluoromethyl)phenyl]-1,2-thiazole-4-carboxylate Traditional Name: 3-[3,5-bis(trifluoromethyl)phenyl]isothiazole-4-carboxylic acid ethyl ester Formula: C14H9F6NO2S MolecularWeight: 369.282179

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSN=C1C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=CSN=C1C2=CC(=CC(=C2)C(F)(F)F)C(F)(F)F

InChI

InChI=1S/C14H9F6NO2S/c1-2-23-12(22)10-6-24-21-11(10)7-3-8(13(15,16)17)5-9(4-7)14(18,19)20/h3-6H,2H2,1H3