dimethyl 2-[(2E)-2-(1,3-dibutyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene)ethylidene]-1,3-dithiole-4,5-dicarboxylate

Systemtic Name: dimethyl 2-[(2E)-2-(1,3-dibutyl-5-oxidanylidene-2-sulfanylidene-imidazolidin-4-ylidene)ethylidene]-1,3-dithiole-4,5-dicarboxylate Openeye Name: dimethyl 2-[(2E)-2-(1,3-dibutyl-5-oxo-2-thioxo-imidazolidin-4-ylidene)ethylidene]-1,3-dithiole-4,5-dicarboxylate CAS Name: 2-[(2E)-2-(1,3-dibutyl-5-oxo-2-sulfanylidene-4-imidazolidinylidene)ethylidene]-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[(2E)-2-(1,3-dibutyl-5-oxo-2-sulfanylideneimidazolidin-4-ylidene)ethylidene]-1,3-dithiole-4,5-dicarboxylate Traditional Name: 2-[(2E)-2-(1,3-dibutyl-5-keto-2-thioxo-imidazolidin-4-ylidene)ethylidene]-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester Formula: C20H26N2O5S3 MolecularWeight: 470.62584

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=CC=C2SC(=C(S2)C(=O)OC)C(=O)OC)C(=O)N(C1=S)CCCC

Isomeric SMILES

CCCCN1/C(=C/C=C2SC(=C(S2)C(=O)OC)C(=O)OC)/C(=O)N(C1=S)CCCC

InChI

InChI=1S/C20H26N2O5S3/c1-5-7-11-21-13(17(23)22(20(21)28)12-8-6-2)9-10-14-29-15(18(24)26-3)16(30-14)19(25)27-4/h9-10H,5-8,11-12H2,1-4H3/b13-9+