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dimethyl 2-[7-ethoxy-2,2-dimethyl-3-thioxo-1-(trifluoroacetyl)-2,3-dihydroquinolin-4(1H)-ylidene]-1,3-dithiole-4,5-dicarboxylate

Catalog ID
STK092822
SMILES CCOc1ccc2c(c1)N(C(=O)C(F)(F)F)C(C(=S)/C/2=C/1\SC(=C(S1)C(=O)OC)C(=O)OC)(C)C

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C22H20F3NO6S3 MW 547.60 g/mol Purity >90% as per NMR
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
InChIKey
MXACKSCCBDZBOC-UHFFFAOYSA-N
Synonyms
314039-75-3
314039753
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
CCOc1ccc2c(c1)N(C(=O)C(F)(F)F)C(C(=S)C2=C1SC(=C(S1)C(=O)OC)C(=O)OC)(C)C
DIMETHYL2(7ETHOXY22DIMETHYL3SULFANYLIDENE1(222TRIFLUOROACETYL)QUINOLIN4YLIDENE)13DITHIOLE45DICARBOXYLATE
dimethyl2(7ethoxy22dimethyl3thioxo1(222trifluoroacetyl)23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
DIMETHYL2(7ETHOXY22DIMETHYL3THIOXO1(TRIFLUOROACETYL)23DIHYDRO4(1H)QUINOLINYLIDENE)13DITHIOLE45DICARBOXYLATE
DIMETHYL2(7ETHOXY22DIMETHYL3THIOXO1(TRIFLUOROACETYL)23DIHYDROQUINOLIN4(1H)YLIDENE)13DITHIOLE45DICARBOXYLATE
InChI=1SC22H20F3NO6S3c163210781112(910)26(20(29)22(2324)25)21(23)16(33)13(11)193414(17(27)304)15(3519)18(28)315h79H6H215H3
METHYL2(7ETHOXY22DIMETHYL3THIOXO1(222TRIFLUOROACETYL)(412DIHYDROQUINOLYLIDENE))5(METHOXYCARBONYL)13DITHIOLENE4CARBOXYLATE
MFCD01796149
STK092822
ZINC000008431793
ZINC08431793
ZINC8431793

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Available files

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