dimethyl 2-[[(Z)-1,2-bis(phenylcarbonylsulfanyl)-2-sulfanyl-ethenyl]sulfanylmethyl]but-2-enedioate

Systemtic Name: dimethyl 2-[[(Z)-1,2-bis(phenylcarbonylsulfanyl)-2-sulfanyl-ethenyl]sulfanylmethyl]but-2-enedioate Openeye Name: dimethyl 2-[[(Z)-1,2-bis(benzoylsulfanyl)-2-sulfanyl-vinyl]sulfanylmethyl]but-2-enedioate CAS Name: 2-[[[(Z)-1,2-bis(benzoylthio)-2-mercaptoethenyl]thio]methyl]-2-butenedioic acid dimethyl ester IUPAC Name: dimethyl 2-[[(Z)-1,2-bis(benzoylsulfanyl)-2-sulfanylethenyl]sulfanylmethyl]but-2-enedioate Traditional Name: 2-[[[(Z)-1,2-bis(benzoylthio)-2-mercapto-vinyl]thio]methyl]but-2-enedioic acid dimethyl ester Formula: C23H20O6S4 MolecularWeight: 520.6613

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=C(CSC(=C(S)SC(=O)C1=CC=CC=C1)SC(=O)C2=CC=CC=C2)C(=O)OC

Isomeric SMILES

COC(=O)C=C(CS/C(=C(\S)/SC(=O)C1=CC=CC=C1)/SC(=O)C2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C23H20O6S4/c1-28-18(24)13-17(19(25)29-2)14-31-23(33-21(27)16-11-7-4-8-12-16)22(30)32-20(26)15-9-5-3-6-10-15/h3-13,30H,14H2,1-2H3/b17-13?,23-22-