methyl 2-[3-(2-methylsulfanyl-2-sulfanylidene-ethanoyl)-5-propanoyl-phenyl]-2-oxidanylidene-ethanedithioate

Systemtic Name: methyl 2-[3-(2-methylsulfanyl-2-sulfanylidene-ethanoyl)-5-propanoyl-phenyl]-2-oxidanylidene-ethanedithioate Openeye Name: methyl 2-[3-(2-methylsulfanyl-2-thioxo-acetyl)-5-propanoyl-phenyl]-2-oxo-ethanedithioate CAS Name: 2-[3-[2-(methylthio)-1-oxo-2-sulfanylideneethyl]-5-(1-oxopropyl)phenyl]-2-oxoethanedithioic acid methyl ester IUPAC Name: methyl 2-[3-(2-methylsulfanyl-2-sulfanylideneacetyl)-5-propanoylphenyl]-2-oxoethanedithioate Traditional Name: 2-keto-2-[3-[2-(methylthio)-2-thioxo-acetyl]-5-propionyl-phenyl]ethanedithioic acid methyl ester Formula: C15H14O3S4 MolecularWeight: 370.52986

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC(=CC(=C1)C(=O)C(=S)SC)C(=O)C(=S)SC

Isomeric SMILES

CCC(=O)C1=CC(=CC(=C1)C(=O)C(=S)SC)C(=O)C(=S)SC

InChI

InChI=1S/C15H14O3S4/c1-4-11(16)8-5-9(12(17)14(19)21-2)7-10(6-8)13(18)15(20)22-3/h5-7H,4H2,1-3H3