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dimethyl 2-[2,2,6-trimethyl-1-(pyridin-3-ylcarbonyl)-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene]-1,3-dithiole-4,5-dicarboxylate

Catalog ID
STK320621
SMILES COC(=O)C1=C(S/C(=C\2/c3cc(C)ccc3N(C(C2=S)(C)C)C(=O)c2cccnc2)/S1)C(=O)OC

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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 C25H22N2O5S3 MW 526.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N2O5S3/c1-13-8-9-16-15(11-13)17(24-34-18(22(29)31-4)19(35-24)23(30)32-5)20(33)25(2,3)27(16)21(28)14-7-6-10-26-12-14/h6-12H,1-5H3
InChIKey
CNSLZMLWOFFRCD-UHFFFAOYSA-N
Synonyms

CC1=CC2=C(C=C1)N(C(C(=S)C2=C3SC(=C(S3)C(=O)OC)C(=O)OC)(C)C)C(=O)C4=CN=CC=C4
COC(=O)C1=C(SC(=C2c3cc(C)ccc3N(C(C2=S)(C)C)C(=O)c2cccnc2)S1)C(=O)OC
DIMETHYL2(226TRIMETHYL1(3PYRIDINYLCARBONYL)3THIOXO23DIHYDRO4(1H)QUINOLINYLIDENE)13DITHIOLE45DICARBOXYLATE
DIMETHYL2(226TRIMETHYL1(PYRIDIN3YLCARBONYL)3THIOXO23DIHYDROQUINOLIN4(1H)YLIDENE)13DITHIOLE45DICARBOXYLATE
DIMETHYL2(226TRIMETHYL1(PYRIDINE3CARBONYL)3SULFANYLIDENEQUINOLIN4YLIDENE)13DITHIOLE45DICARBOXYLATE
DIMETHYL2(226TRIMETHYL1(PYRIDINE3CARBONYL)3THIOXO4QUINOLYLIDENE)13DITHIOLE45DICARBOXYLATE
dimethyl2(226trimethyl1nicotinoyl3thioxo23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
InChI=1SC25H22N2O5S3c113891615(1113)17(243418(22(29)314)19(3524)23(30)325)20(33)25(23)27(16)21(28)147610261214h612H15H3
MFCD01975668
ZINC000008431969
ZINC08431969
ZINC8431969

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Available files

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