2-[2-[(ethyldisulfanyl)methyl]-4-methoxy-3-methyl-pyridin-1-ium-1-yl]-6-(trifluoromethyl)-1H-benzimidazole chloride

Systemtic Name: 2-[2-[(ethyldisulfanyl)methyl]-4-methoxy-3-methyl-pyridin-1-ium-1-yl]-6-(trifluoromethyl)-1H-benzimidazole chloride Openeye Name: 2-[2-[(ethyldisulfanyl)methyl]-4-methoxy-3-methyl-pyridin-1-ium-1-yl]-6-(trifluoromethyl)-1H-benzimidazole chloride CAS Name: 2-[2-[(ethyldisulfanyl)methyl]-4-methoxy-3-methyl-1-pyridin-1-iumyl]-6-(trifluoromethyl)-1H-benzimidazole chloride IUPAC Name: 2-[2-[(ethyldisulfanyl)methyl]-4-methoxy-3-methylpyridin-1-ium-1-yl]-6-(trifluoromethyl)-1H-benzimidazole chloride Traditional Name: 2-[2-[(ethyldisulfanyl)methyl]-4-methoxy-3-methyl-pyridin-1-ium-1-yl]-6-(trifluoromethyl)-1H-benzimidazole chloride Formula: C18H19ClF3N3OS2 MolecularWeight: 449.94117

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Descriptors Computed from Structure

Canonical SMILES:

CCSSCC1=[N+](C=CC(=C1C)OC)C2=NC3=C(N2)C=C(C=C3)C(F)(F)F.[Cl-]

Isomeric SMILES

CCSSCC1=[N+](C=CC(=C1C)OC)C2=NC3=C(N2)C=C(C=C3)C(F)(F)F.[Cl-]

InChI

InChI=1S/C18H19F3N3OS2.ClH/c1-4-26-27-10-15-11(2)16(25-3)7-8-24(15)17-22-13-6-5-12(18(19,20)21)9-14(13)23-17;/h5-9H,4,10H2,1-3H3,(H,22,23);1H/q+1;/p-1