ethyl 5-cyclopropyl-4-[[4-(trifluoromethylsulfanyl)phenyl]carbamoyl]-1,2-oxazole-3-carboxylate

Systemtic Name: ethyl 5-cyclopropyl-4-[[4-(trifluoromethylsulfanyl)phenyl]carbamoyl]-1,2-oxazole-3-carboxylate Openeye Name: ethyl 5-cyclopropyl-4-[[4-(trifluoromethylsulfanyl)phenyl]carbamoyl]isoxazole-3-carboxylate CAS Name: 5-cyclopropyl-4-[oxo-[4-(trifluoromethylthio)anilino]methyl]-3-isoxazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-cyclopropyl-4-[[4-(trifluoromethylsulfanyl)phenyl]carbamoyl]-1,2-oxazole-3-carboxylate Traditional Name: 5-cyclopropyl-4-[[4-(trifluoromethylthio)phenyl]carbamoyl]isoxazole-3-carboxylic acid ethyl ester Formula: C17H15F3N2O4S MolecularWeight: 400.37221

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NOC(=C1C(=O)NC2=CC=C(C=C2)SC(F)(F)F)C3CC3

Isomeric SMILES

CCOC(=O)C1=NOC(=C1C(=O)NC2=CC=C(C=C2)SC(F)(F)F)C3CC3

InChI

InChI=1S/C17H15F3N2O4S/c1-2-25-16(24)13-12(14(26-22-13)9-3-4-9)15(23)21-10-5-7-11(8-6-10)27-17(18,19)20/h5-9H,2-4H2,1H3,(H,21,23)