N-(3-chloranyl-4-fluoranyl-phenyl)-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(3-chloranyl-4-fluoranyl-phenyl)-2-(1-oxidanidylpyridin-1-ium-2-yl)sulfanyl-ethanamide Openeye Name: N-(3-chloro-4-fluoro-phenyl)-2-(1-oxidopyridin-1-ium-2-yl)sulfanyl-acetamide CAS Name: N-(3-chloro-4-fluorophenyl)-2-[(1-oxido-2-pyridin-1-iumyl)thio]acetamide IUPAC Name: N-(3-chloro-4-fluorophenyl)-2-(1-oxidopyridin-1-ium-2-yl)sulfanylacetamide Traditional Name: N-(3-chloro-4-fluoro-phenyl)-2-[(1-oxidopyridin-1-ium-2-yl)thio]acetamide Formula: C13H10ClFN2O2S MolecularWeight: 312.747103

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H10ClFN2O2S/c14-10-7-9(4-5-11(10)15)16-12(18)8-20-13-3-1-2-6-17(13)19/h1-7H,8H2,(H,16,18)