dimethyl 2-[7-ethoxy-2,2-dimethyl-3-sulfanylidene-1-[2,2,2-tris(fluoranyl)ethanoyl]quinolin-4-ylidene]-1,3-dithiole-4,5-dicarboxylate

Systemtic Name: dimethyl 2-[7-ethoxy-2,2-dimethyl-3-sulfanylidene-1-[2,2,2-tris(fluoranyl)ethanoyl]quinolin-4-ylidene]-1,3-dithiole-4,5-dicarboxylate Openeye Name: dimethyl 2-[7-ethoxy-2,2-dimethyl-3-thioxo-1-(2,2,2-trifluoroacetyl)-4-quinolylidene]-1,3-dithiole-4,5-dicarboxylate CAS Name: 2-[7-ethoxy-2,2-dimethyl-3-sulfanylidene-1-(2,2,2-trifluoro-1-oxoethyl)-4-quinolinylidene]-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 2-[7-ethoxy-2,2-dimethyl-3-sulfanylidene-1-(2,2,2-trifluoroacetyl)quinolin-4-ylidene]-1,3-dithiole-4,5-dicarboxylate Traditional Name: 2-[7-ethoxy-2,2-dimethyl-3-thioxo-1-(2,2,2-trifluoroacetyl)-4-quinolylidene]-1,3-dithiole-4,5-dicarboxylic acid dimethyl ester Formula: C22H20F3NO6S3 MolecularWeight: 547.58751

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)C(=C3SC(=C(S3)C(=O)OC)C(=O)OC)C(=S)C(N2C(=O)C(F)(F)F)(C)C

Isomeric SMILES

CCOC1=CC2=C(C=C1)C(=C3SC(=C(S3)C(=O)OC)C(=O)OC)C(=S)C(N2C(=O)C(F)(F)F)(C)C

InChI

InChI=1S/C22H20F3NO6S3/c1-6-32-10-7-8-11-12(9-10)26(20(29)22(23,24)25)21(2,3)16(33)13(11)19-34-14(17(27)30-4)15(35-19)18(28)31-5/h7-9H,6H2,1-5H3