dimethyl 2-[8-ethoxy-2,2-dimethyl-1-(2-phenoxyethanoyl)-3-sulfanylidene-quinolin-4-ylidene]-1,3-dithiole-4,5-dicarboxylate

Systemtic Name: dimethyl 2-[8-ethoxy-2,2-dimethyl-1-(2-phenoxyethanoyl)-3-sulfanylidene-quinolin-4-ylidene]-1,3-dithiole-4,5-dicarboxylate Openeye Name: dimethyl 2-[8-ethoxy-2,2-dimethyl-1-(2-phenoxyacetyl)-3-thioxo-4-quinolylidene]-1,3-dithiole-4,5-dicarboxylate CAS Name: 2-[8-ethoxy-2,2-dimethyl-1-(1-oxo-2-phenoxyethyl)-3-sulfanylidene-4-quinolinylidene]-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[8-ethoxy-2,2-dimethyl-1-(2-phenoxyacetyl)-3-sulfanylidenequinolin-4-ylidene]-1,3-dithiole-4,5-dicarboxylate Traditional Name: 2-[8-ethoxy-2,2-dimethyl-1-(2-phenoxyacetyl)-3-thioxo-4-quinolylidene]-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester Formula: C28H27NO7S3 MolecularWeight: 585.71148

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC2=C1N(C(C(=S)C2=C3SC(=C(S3)C(=O)OC)C(=O)OC)(C)C)C(=O)COC4=CC=CC=C4

Isomeric SMILES

CCOC1=CC=CC2=C1N(C(C(=S)C2=C3SC(=C(S3)C(=O)OC)C(=O)OC)(C)C)C(=O)COC4=CC=CC=C4

InChI

InChI=1S/C28H27NO7S3/c1-6-35-18-14-10-13-17-20(27-38-22(25(31)33-4)23(39-27)26(32)34-5)24(37)28(2,3)29(21(17)18)19(30)15-36-16-11-8-7-9-12-16/h7-14H,6,15H2,1-5H3