2-[(3,4-dichlorophenyl)methylsulfanyl]-1-methyl-pyridin-1-ium

Systemtic Name: 2-[(3,4-dichlorophenyl)methylsulfanyl]-1-methyl-pyridin-1-ium Openeye Name: 2-[(3,4-dichlorophenyl)methylsulfanyl]-1-methyl-pyridin-1-ium CAS Name: 2-[(3,4-dichlorophenyl)methylthio]-1-methylpyridin-1-ium IUPAC Name: 2-[(3,4-dichlorophenyl)methylsulfanyl]-1-methylpyridin-1-ium Traditional Name: 2-[(3,4-dichlorobenzyl)thio]-1-methyl-pyridin-1-ium Formula: C13H12Cl2NS+ MolecularWeight: 285.21208

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC=C1SCC2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

C[N+]1=CC=CC=C1SCC2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C13H12Cl2NS/c1-16-7-3-2-4-13(16)17-9-10-5-6-11(14)12(15)8-10/h2-8H,9H2,1H3/q+1