2-[(2-chloranyl-4-fluoranyl-phenyl)methylsulfanyl]-1-oxidanidyl-pyridin-1-ium

Systemtic Name: 2-[(2-chloranyl-4-fluoranyl-phenyl)methylsulfanyl]-1-oxidanidyl-pyridin-1-ium Openeye Name: 2-[(2-chloro-4-fluoro-phenyl)methylsulfanyl]-1-oxido-pyridin-1-ium CAS Name: 2-[(2-chloro-4-fluorophenyl)methylthio]-1-oxidopyridin-1-ium IUPAC Name: 2-[(2-chloro-4-fluorophenyl)methylsulfanyl]-1-oxidopyridin-1-ium Traditional Name: 2-[(2-chloro-4-fluoro-benzyl)thio]-1-oxido-pyridin-1-ium Formula: C12H9ClFNOS MolecularWeight: 269.722363

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C(=C1)SCC2=C(C=C(C=C2)F)Cl)[O-]

Isomeric SMILES

C1=CC=[N+](C(=C1)SCC2=C(C=C(C=C2)F)Cl)[O-]

InChI

InChI=1S/C12H9ClFNOS/c13-11-7-10(14)5-4-9(11)8-17-12-3-1-2-6-15(12)16/h1-7H,8H2