dimethyl 2-(1-chloranyl-2-morpholin-4-yl-2-sulfanylidene-ethylidene)-1,3-dithiole-4,5-dicarboxylate

Systemtic Name: dimethyl 2-(1-chloranyl-2-morpholin-4-yl-2-sulfanylidene-ethylidene)-1,3-dithiole-4,5-dicarboxylate Openeye Name: dimethyl 2-(1-chloro-2-morpholino-2-thioxo-ethylidene)-1,3-dithiole-4,5-dicarboxylate CAS Name: 2-[1-chloro-2-(4-morpholinyl)-2-sulfanylideneethylidene]-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-(1-chloro-2-morpholin-4-yl-2-sulfanylideneethylidene)-1,3-dithiole-4,5-dicarboxylate Traditional Name: 2-(1-chloro-2-morpholino-2-thioxo-ethylidene)-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester Formula: C13H14ClNO5S3 MolecularWeight: 395.90196

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=C(C(=S)N2CCOCC2)Cl)S1)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(SC(=C(C(=S)N2CCOCC2)Cl)S1)C(=O)OC

InChI

InChI=1S/C13H14ClNO5S3/c1-18-11(16)8-9(12(17)19-2)23-13(22-8)7(14)10(21)15-3-5-20-6-4-15/h3-6H2,1-2H3