N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethanamide Openeye Name: N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]-2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-acetamide CAS Name: N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]-2-[(1-oxido-2-pyridin-1-iumyl)thio]acetamide IUPAC Name: N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]-2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetamide Traditional Name: N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]-2-[(1-oxidopyridin-1-ium-2-yl)thio]acetamide Formula: C17H17F3N2O4S MolecularWeight: 402.38809

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Descriptors Computed from Structure

Canonical SMILES:

COCCOC1=C(C=C(C=C1)C(F)(F)F)NC(=O)CSC2=CC=CC=[N+]2[O-]

Isomeric SMILES

COCCOC1=C(C=C(C=C1)C(F)(F)F)NC(=O)CSC2=CC=CC=[N+]2[O-]

InChI

InChI=1S/C17H17F3N2O4S/c1-25-8-9-26-14-6-5-12(17(18,19)20)10-13(14)21-15(23)11-27-16-4-2-3-7-22(16)24/h2-7,10H,8-9,11H2,1H3,(H,21,23)