diethyl (3E)-2-oxidanylidene-3-[(4-oxidanylidene-2-sulfanylidene-imidazolidin-1-yl)methylidene]butanedioate

Systemtic Name: diethyl (3E)-2-oxidanylidene-3-[(4-oxidanylidene-2-sulfanylidene-imidazolidin-1-yl)methylidene]butanedioate Openeye Name: diethyl (3E)-2-oxo-3-[(4-oxo-2-thioxo-imidazolidin-1-yl)methylene]butanedioate CAS Name: (3E)-2-oxo-3-[(4-oxo-2-sulfanylidene-1-imidazolidinyl)methylidene]butanedioic acid diethyl ester IUPAC Name: diethyl (3E)-2-oxo-3-[(4-oxo-2-sulfanylideneimidazolidin-1-yl)methylidene]butanedioate Traditional Name: (3E)-2-keto-3-[(4-keto-2-thioxo-imidazolidin-1-yl)methylene]succinic acid diethyl ester Formula: C12H14N2O6S MolecularWeight: 314.31436

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(=CN1CC(=O)NC1=S)C(=O)C(=O)OCC

Isomeric SMILES

CCOC(=O)/C(=C/N1CC(=O)NC1=S)/C(=O)C(=O)OCC

InChI

InChI=1S/C12H14N2O6S/c1-3-19-10(17)7(9(16)11(18)20-4-2)5-14-6-8(15)13-12(14)21/h5H,3-4,6H2,1-2H3,(H,13,15,21)/b7-5+