Vitas-M small molecule compound
dimethyl 2-(1-acetyl-8-methoxy-2,2-dimethyl-3-thioxo-2,3-dihydroquinolin-4(1H)-ylidene)-1,3-dithiole-4,5-dicarboxylate
Catalog ID
STK320665
SMILES COC(=O)C1=C(S/C(=C\2/c3cccc(c3N(C(C2=S)(C)C)C(=O)C)OC)/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 C21H21NO6S3 MW 479.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21NO6S3/c1-10(23)22-14-11(8-7-9-12(14)26-4)13(17(29)21(22,2)3)20-30-15(18(24)27-5)16(31-20)19(25)28-6/h7-9H,1-6H3InChIKey
ZYVDPJYPOAMEFO-UHFFFAOYSA-NSynonyms
933551-10-1933551101
CC(=O)N1C2=C(C=CC=C2OC)C(=C3SC(=C(S3)C(=O)OC)C(=O)OC)C(=S)C1(C)C
COC(=O)C1=C(SC(=C2c3cccc(c3N(C(C2=S)(C)C)C(=O)C)OC)S1)C(=O)OC
dimethyl2(1acetyl8methoxy22dimethyl3sulfanylidenequinolin4ylidene)13dithiole45dicarboxylate
dimethyl2(1acetyl8methoxy22dimethyl3thioxo23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
InChI=1SC21H21NO6S3c110(23)221411(87912(14)264)13(17(29)21(222)3)203015(18(24)275)16(3120)19(25)286h79H16H3
MFCD08573152
ZINC000009926595
ZINC09926595
ZINC9926595
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