bis(2-ethylsulfanylethyl) 1H-imidazole-4,5-dicarboxylate

Systemtic Name: bis(2-ethylsulfanylethyl) 1H-imidazole-4,5-dicarboxylate Openeye Name: bis(2-ethylsulfanylethyl) 1H-imidazole-4,5-dicarboxylate CAS Name: 1H-imidazole-4,5-dicarboxylic acid bis[2-(ethylthio)ethyl] ester IUPAC Name: bis(2-ethylsulfanylethyl) 1H-imidazole-4,5-dicarboxylate Traditional Name: 1H-imidazole-4,5-dicarboxylic acid bis[2-(ethylthio)ethyl] ester Formula: C13H20N2O4S2 MolecularWeight: 332.4389

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Descriptors Computed from Structure

Canonical SMILES:

CCSCCOC(=O)C1=C(N=CN1)C(=O)OCCSCC

Isomeric SMILES

CCSCCOC(=O)C1=C(N=CN1)C(=O)OCCSCC

InChI

InChI=1S/C13H20N2O4S2/c1-3-20-7-5-18-12(16)10-11(15-9-14-10)13(17)19-6-8-21-4-2/h9H,3-8H2,1-2H3,(H,14,15)