[2-oxidanylidene-2-[[2-(trifluoromethyl)phenyl]amino]ethyl] 5-azanyl-3-methyl-1,2-thiazole-4-carboxylate

Systemtic Name: [2-oxidanylidene-2-[[2-(trifluoromethyl)phenyl]amino]ethyl] 5-azanyl-3-methyl-1,2-thiazole-4-carboxylate Openeye Name: [2-oxo-2-[2-(trifluoromethyl)anilino]ethyl] 5-amino-3-methyl-isothiazole-4-carboxylate CAS Name: 5-amino-3-methyl-4-isothiazolecarboxylic acid [2-oxo-2-[2-(trifluoromethyl)anilino]ethyl] ester IUPAC Name: [2-oxo-2-[2-(trifluoromethyl)anilino]ethyl] 5-amino-3-methyl-1,2-thiazole-4-carboxylate Traditional Name: 5-amino-3-methyl-isothiazole-4-carboxylic acid [2-keto-2-[2-(trifluoromethyl)anilino]ethyl] ester Formula: C14H12F3N3O3S MolecularWeight: 359.32359

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NSC(=C1C(=O)OCC(=O)NC2=CC=CC=C2C(F)(F)F)N

Isomeric SMILES

CC1=NSC(=C1C(=O)OCC(=O)NC2=CC=CC=C2C(F)(F)F)N

InChI

InChI=1S/C14H12F3N3O3S/c1-7-11(12(18)24-20-7)13(22)23-6-10(21)19-9-5-3-2-4-8(9)14(15,16)17/h2-5H,6,18H2,1H3,(H,19,21)