ethyl 3-methyl-5-[2-[3-(trifluoromethyl)phenoxy]butanoylamino]-1,2-thiazole-4-carboxylate

Systemtic Name: ethyl 3-methyl-5-[2-[3-(trifluoromethyl)phenoxy]butanoylamino]-1,2-thiazole-4-carboxylate Openeye Name: ethyl 3-methyl-5-[2-[3-(trifluoromethyl)phenoxy]butanoylamino]isothiazole-4-carboxylate CAS Name: 3-methyl-5-[[1-oxo-2-[3-(trifluoromethyl)phenoxy]butyl]amino]-4-isothiazolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-methyl-5-[2-[3-(trifluoromethyl)phenoxy]butanoylamino]-1,2-thiazole-4-carboxylate Traditional Name: 3-methyl-5-[2-[3-(trifluoromethyl)phenoxy]butanoylamino]isothiazole-4-carboxylic acid ethyl ester Formula: C18H19F3N2O4S MolecularWeight: 416.41467

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C(=NS1)C)C(=O)OCC)OC2=CC=CC(=C2)C(F)(F)F

Isomeric SMILES

CCC(C(=O)NC1=C(C(=NS1)C)C(=O)OCC)OC2=CC=CC(=C2)C(F)(F)F

InChI

InChI=1S/C18H19F3N2O4S/c1-4-13(27-12-8-6-7-11(9-12)18(19,20)21)15(24)22-16-14(10(3)23-28-16)17(25)26-5-2/h6-9,13H,4-5H2,1-3H3,(H,22,24)