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

Systemtic Name: ethyl 2-[[3-(trifluoromethyl)phenyl]methylsulfonylmethyl]-1,3-thiazole-4-carboxylate Openeye Name: ethyl 2-[[3-(trifluoromethyl)phenyl]methylsulfonylmethyl]thiazole-4-carboxylate CAS Name: 2-[[3-(trifluoromethyl)phenyl]methylsulfonylmethyl]-4-thiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[3-(trifluoromethyl)phenyl]methylsulfonylmethyl]-1,3-thiazole-4-carboxylate Traditional Name: 2-[[3-(trifluoromethyl)benzyl]sulfonylmethyl]thiazole-4-carboxylic acid ethyl ester Formula: C15H14F3NO4S2 MolecularWeight: 393.40117

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CSC(=N1)CS(=O)(=O)CC2=CC(=CC=C2)C(F)(F)F

Isomeric SMILES

CCOC(=O)C1=CSC(=N1)CS(=O)(=O)CC2=CC(=CC=C2)C(F)(F)F

InChI

InChI=1S/C15H14F3NO4S2/c1-2-23-14(20)12-7-24-13(19-12)9-25(21,22)8-10-4-3-5-11(6-10)15(16,17)18/h3-7H,2,8-9H2,1H3