ethyl 3-[2,3,6-tris(fluoranyl)-4-methyl-phenyl]-1,2-thiazole-4-carboxylate

Systemtic Name: ethyl 3-[2,3,6-tris(fluoranyl)-4-methyl-phenyl]-1,2-thiazole-4-carboxylate Openeye Name: ethyl 3-(2,3,6-trifluoro-4-methyl-phenyl)isothiazole-4-carboxylate CAS Name: 3-(2,3,6-trifluoro-4-methylphenyl)-4-isothiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-(2,3,6-trifluoro-4-methylphenyl)-1,2-thiazole-4-carboxylate Traditional Name: 3-(2,3,6-trifluoro-4-methyl-phenyl)isothiazole-4-carboxylic acid ethyl ester Formula: C13H10F3NO2S MolecularWeight: 301.28421

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSN=C1C2=C(C=C(C(=C2F)F)C)F

Isomeric SMILES

CCOC(=O)C1=CSN=C1C2=C(C=C(C(=C2F)F)C)F

InChI

InChI=1S/C13H10F3NO2S/c1-3-19-13(18)7-5-20-17-12(7)9-8(14)4-6(2)10(15)11(9)16/h4-5H,3H2,1-2H3