3-chloranyl-2-[(1-oxidanidylpyridin-1-ium-2-yl)sulfanylmethyl]-5-(trifluoromethyl)pyridine

Systemtic Name: 3-chloranyl-2-[(1-oxidanidylpyridin-1-ium-2-yl)sulfanylmethyl]-5-(trifluoromethyl)pyridine Openeye Name: 3-chloro-2-[(1-oxidopyridin-1-ium-2-yl)sulfanylmethyl]-5-(trifluoromethyl)pyridine CAS Name: 3-chloro-2-[[(1-oxido-2-pyridin-1-iumyl)thio]methyl]-5-(trifluoromethyl)pyridine IUPAC Name: 3-chloro-2-[(1-oxidopyridin-1-ium-2-yl)sulfanylmethyl]-5-(trifluoromethyl)pyridine Traditional Name: 3-chloro-2-[[(1-oxidopyridin-1-ium-2-yl)thio]methyl]-5-(trifluoromethyl)pyridine Formula: C12H8ClF3N2OS MolecularWeight: 320.71793

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C(=C1)SCC2=C(C=C(C=N2)C(F)(F)F)Cl)[O-]

Isomeric SMILES

C1=CC=[N+](C(=C1)SCC2=C(C=C(C=N2)C(F)(F)F)Cl)[O-]

InChI

InChI=1S/C12H8ClF3N2OS/c13-9-5-8(12(14,15)16)6-17-10(9)7-20-11-3-1-2-4-18(11)19/h1-6H,7H2