2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-N-[2,3,4-tris(fluoranyl)phenyl]ethanamide

Systemtic Name: 2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-N-[2,3,4-tris(fluoranyl)phenyl]ethanamide Openeye Name: 2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-N-(2,3,4-trifluorophenyl)acetamide CAS Name: 2-[(1-oxido-2-pyridin-1-iumyl)thio]-N-(2,3,4-trifluorophenyl)acetamide IUPAC Name: 2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-N-(2,3,4-trifluorophenyl)acetamide Traditional Name: 2-[(1-oxidopyridin-1-ium-2-yl)thio]-N-(2,3,4-trifluorophenyl)acetamide Formula: C13H9F3N2O2S MolecularWeight: 314.28297

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C(=C1)SCC(=O)NC2=C(C(=C(C=C2)F)F)F)[O-]

Isomeric SMILES

C1=CC=[N+](C(=C1)SCC(=O)NC2=C(C(=C(C=C2)F)F)F)[O-]

InChI

InChI=1S/C13H9F3N2O2S/c14-8-4-5-9(13(16)12(8)15)17-10(19)7-21-11-3-1-2-6-18(11)20/h1-6H,7H2,(H,17,19)