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

Catalog ID
STK018507
SMILES COC(=O)C1=C(S/C(=C\2/c3ccccc3N(C(C2=S)(C)C)C(=O)c2ccccc2)/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 C25H21NO5S3 MW 511.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21NO5S3/c1-25(2)20(32)17(24-33-18(22(28)30-3)19(34-24)23(29)31-4)15-12-8-9-13-16(15)26(25)21(27)14-10-6-5-7-11-14/h5-13H,1-4H3
InChIKey
ADDLFKIECTYTOU-UHFFFAOYSA-N
Synonyms
258267-16-2
258267162
CC1(C(=S)C(=C2SC(=C(S2)C(=O)OC)C(=O)OC)C3=CC=CC=C3N1C(=O)C4=CC=CC=C4)C
COC(=O)C1=C(SC(=C2c3ccccc3N(C(C2=S)(C)C)C(=O)c2ccccc2)S1)C(=O)OC
DIMETHYL2(1BENZOYL22DIMETHYL3SULFANYLIDENEQUINOLIN4YLIDENE)13DITHIOLE45DICARBOXYLATE
DIMETHYL2(1BENZOYL22DIMETHYL3THIOXO23DIHYDRO4(1H)QUINOLINYLIDENE)13DITHIOLE45DICARBOXYLATE
dimethyl2(1benzoyl22dimethyl3thioxo23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
DIMETHYL2(22DIMETHYL1(PHENYLCARBONYL)3THIOXO23DIHYDROQUINOLIN4(1H)YLIDENE)13DITHIOLE45DICARBOXYLATE
InChI=1SC25H21NO5S3c125(2)20(32)17(243318(22(28)303)19(3424)23(29)314)1512891316(15)26(25)21(27)14106571114h513H14H3
METHYL2(22DIMETHYL1(PHENYLCARBONYL)3THIOXO(412DIHYDROQUINOLYLIDENE))5(METHOXYCARBONYL)13DITHIOLENE4CARBOXYLATE
MFCD00627097
STK018507
ZINC000006191004
ZINC06191004
ZINC6191004

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Available files

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