4-methylsulfanyl-1-[(4-methylsulfanylpyridin-1-ium-1-yl)methoxymethyl]pyridin-1-ium dichloride

Systemtic Name: 4-methylsulfanyl-1-[(4-methylsulfanylpyridin-1-ium-1-yl)methoxymethyl]pyridin-1-ium dichloride Openeye Name: 4-methylsulfanyl-1-[(4-methylsulfanylpyridin-1-ium-1-yl)methoxymethyl]pyridin-1-ium dichloride CAS Name: 4-(methylthio)-1-[[4-(methylthio)-1-pyridin-1-iumyl]methoxymethyl]pyridin-1-ium dichloride IUPAC Name: 4-methylsulfanyl-1-[(4-methylsulfanylpyridin-1-ium-1-yl)methoxymethyl]pyridin-1-ium dichloride Traditional Name: 4-(methylthio)-1-[[4-(methylthio)pyridin-1-ium-1-yl]methoxymethyl]pyridin-1-ium dichloride Formula: C14H18Cl2N2OS2 MolecularWeight: 365.34152

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=[N+](C=C1)COC[N+]2=CC=C(C=C2)SC.[Cl-].[Cl-]

Isomeric SMILES

CSC1=CC=[N+](C=C1)COC[N+]2=CC=C(C=C2)SC.[Cl-].[Cl-]

InChI

InChI=1S/C14H18N2OS2.2ClH/c1-18-13-3-7-15(8-4-13)11-17-12-16-9-5-14(19-2)6-10-16;;/h3-10H,11-12H2,1-2H3;2*1H/q+2;;/p-2