dimethyl 2-[1-cyano-2,2-bis(sulfanyl)ethenyl]-5-sulfanyl-1H-pyrrole-3,4-dicarboxylate

Systemtic Name: dimethyl 2-[1-cyano-2,2-bis(sulfanyl)ethenyl]-5-sulfanyl-1H-pyrrole-3,4-dicarboxylate Openeye Name: dimethyl 2-[1-cyano-2,2-bis(sulfanyl)vinyl]-5-sulfanyl-1H-pyrrole-3,4-dicarboxylate CAS Name: 2-(1-cyano-2,2-dimercaptoethenyl)-5-mercapto-1H-pyrrole-3,4-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[1-cyano-2,2-bis(sulfanyl)ethenyl]-5-sulfanyl-1H-pyrrole-3,4-dicarboxylate Traditional Name: 2-(1-cyano-2,2-dimercapto-vinyl)-5-mercapto-1H-pyrrole-3,4-dicarboxylic acid dimethyl ester Formula: C11H10N2O4S3 MolecularWeight: 330.4031

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(NC(=C1C(=O)OC)S)C(=C(S)S)C#N

Isomeric SMILES

COC(=O)C1=C(NC(=C1C(=O)OC)S)C(=C(S)S)C#N

InChI

InChI=1S/C11H10N2O4S3/c1-16-9(14)5-6(10(15)17-2)8(18)13-7(5)4(3-12)11(19)20/h13,18-20H,1-2H3