dimethyl 2-[4,5-bis(methylsulfanyl)-1,3-dithiol-2-ylidene]-1,3-dithiole-4,5-dicarboxylate

Systemtic Name: dimethyl 2-[4,5-bis(methylsulfanyl)-1,3-dithiol-2-ylidene]-1,3-dithiole-4,5-dicarboxylate Openeye Name: dimethyl 2-[4,5-bis(methylsulfanyl)-1,3-dithiol-2-ylidene]-1,3-dithiole-4,5-dicarboxylate CAS Name: 2-[4,5-bis(methylthio)-1,3-dithiol-2-ylidene]-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[4,5-bis(methylsulfanyl)-1,3-dithiol-2-ylidene]-1,3-dithiole-4,5-dicarboxylate Traditional Name: 2-[4,5-bis(methylthio)-1,3-dithiol-2-ylidene]-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester Formula: C12H12O4S6 MolecularWeight: 412.61128

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=C2SC(=C(S2)SC)SC)S1)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(SC(=C2SC(=C(S2)SC)SC)S1)C(=O)OC

InChI

InChI=1S/C12H12O4S6/c1-15-7(13)5-6(8(14)16-2)20-11(19-5)12-21-9(17-3)10(18-4)22-12/h1-4H3