Vitas-M small molecule compound
diethyl 2-(1-butanoyl-6-methoxy-2,2-dimethyl-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene)-1,3-dithiole-4,5-dicarboxylate
Catalog ID
STK107047
SMILES CCCC(=O)N1c2ccc(cc2/C(=C\2/SC(=C(S2)C(=O)OCC)C(=O)OCC)/C(=S)C1(C)C)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 C25H29NO6S3 MW 535.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29NO6S3/c1-7-10-17(27)26-16-12-11-14(30-6)13-15(16)18(21(33)25(26,4)5)24-34-19(22(28)31-8-2)20(35-24)23(29)32-9-3/h11-13H,7-10H2,1-6H3InChIKey
XMSBIXJEEJTLOH-UHFFFAOYSA-NSynonyms
500146-02-1500146021
CCCC(=O)N1C2=C(C=C(C=C2)OC)C(=C3SC(=C(S3)C(=O)OCC)C(=O)OCC)C(=S)C1(C)C
CCCC(=O)N1c2ccc(cc2C(=C2SC(=C(S2)C(=O)OCC)C(=O)OCC)C(=S)C1(C)C)OC
DIETHYL2(1BUTANOYL6METHOXY22DIMETHYL3SULFANYLIDENEQUINOLIN4YLIDENE)13DITHIOLE45DICARBOXYLATE
DIETHYL2(1BUTANOYL6METHOXY22DIMETHYL3THIOXO23DIHYDROQUINOLIN4(1H)YLIDENE)13DITHIOLE45DICARBOXYLATE
diethyl2(1butyryl6methoxy22dimethyl3thioxo23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
ETHYL2(1BUTANOYL6METHOXY22DIMETHYL3THIOXO(412DIHYDROQUINOLYLIDENE))5(ETHOXYCARBONYL)13DITHIOLENE4CARBOXYLATE
InChI=1SC25H29NO6S3c171017(27)2616121114(306)1315(16)18(21(33)25(264)5)243419(22(28)3182)20(3524)23(29)3293h1113H710H216H3
MFCD03304529
ZINC000100118203
ZINC100118203
Check stock
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Check stock on Vitas-MAvailable files
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