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

Systemtic Name: N-[3,4-bis(fluoranyl)phenyl]-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethanamide Openeye Name: N-(3,4-difluorophenyl)-2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-acetamide CAS Name: N-(3,4-difluorophenyl)-2-[(1-oxido-2-pyridin-1-iumyl)thio]acetamide IUPAC Name: N-(3,4-difluorophenyl)-2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetamide Traditional Name: N-(3,4-difluorophenyl)-2-[(1-oxidopyridin-1-ium-2-yl)thio]acetamide Formula: C13H10F2N2O2S MolecularWeight: 296.292506

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10F2N2O2S/c14-10-5-4-9(7-11(10)15)16-12(18)8-20-13-3-1-2-6-17(13)19/h1-7H,8H2,(H,16,18)