methyl 5-[2-[(5-methoxycarbonyl-1,3-dithiol-3-ium-4-yl)sulfanyl]ethylsulfanyl]-1,3-dithiol-1-ium-4-carboxylate

Systemtic Name: methyl 5-[2-[(5-methoxycarbonyl-1,3-dithiol-3-ium-4-yl)sulfanyl]ethylsulfanyl]-1,3-dithiol-1-ium-4-carboxylate Openeye Name: methyl 5-[2-[(5-methoxycarbonyl-1,3-dithiol-3-ium-4-yl)sulfanyl]ethylsulfanyl]-1,3-dithiol-1-ium-4-carboxylate CAS Name: 5-[2-[(5-methoxycarbonyl-1,3-dithiol-3-ium-4-yl)thio]ethylthio]-1,3-dithiol-1-ium-4-carboxylic acid methyl ester IUPAC Name: methyl 5-[2-[(5-methoxycarbonyl-1,3-dithiol-3-ium-4-yl)sulfanyl]ethylsulfanyl]-1,3-dithiol-1-ium-4-carboxylate Traditional Name: 5-[2-[(5-carbomethoxy-1,3-dithiol-3-ium-4-yl)thio]ethylthio]-1,3-dithiol-1-ium-4-carboxylic acid methyl ester Formula: C12H12O4S6+2 MolecularWeight: 412.61128

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C([S+]=CS1)SCCSC2=C(SC=[S+]2)C(=O)OC

Isomeric SMILES

COC(=O)C1=C([S+]=CS1)SCCSC2=C(SC=[S+]2)C(=O)OC

InChI

InChI=1S/C12H12O4S6/c1-15-9(13)7-11(21-5-19-7)17-3-4-18-12-8(10(14)16-2)20-6-22-12/h5-6H,3-4H2,1-2H3/q+2