Vitas-M small molecule compound
dimethyl 2-[7-methoxy-2,2-dimethyl-3-thioxo-1-(trifluoroacetyl)-2,3-dihydroquinolin-4(1H)-ylidene]-1,3-dithiole-4,5-dicarboxylate
Catalog ID
STK395096
SMILES COc1ccc2c(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 C21H18F3NO6S3 MW 533.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18F3NO6S3/c1-20(2)15(32)12(18-33-13(16(26)30-4)14(34-18)17(27)31-5)10-7-6-9(29-3)8-11(10)25(20)19(28)21(22,23)24/h6-8H,1-5H3InChIKey
MFOLRHYFWYWNDR-UHFFFAOYSA-NSynonyms
331416-94-5331416945
CC1(C(=S)C(=C2SC(=C(S2)C(=O)OC)C(=O)OC)C3=C(N1C(=O)C(F)(F)F)C=C(C=C3)OC)C
COc1ccc2c(c1)N(C(=O)C(F)(F)F)C(C(=S)C2=C1SC(=C(S1)C(=O)OC)C(=O)OC)(C)C
DIMETHYL2(7METHOXY22DIMETHYL3SULFANYLIDENE1(222TRIFLUOROACETYL)QUINOLIN4YLIDENE)13DITHIOLE45DICARBOXYLATE
dimethyl2(7methoxy22dimethyl3thioxo1(222trifluoroacetyl)23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
dimethyl2(7methoxy22dimethyl3thioxo1(trifluoroacetyl)23dihydroquinolin4(1H)ylidene)13dithiole45dicarboxylate
InChI=1SC21H18F3NO6S3c120(2)15(32)12(183313(16(26)304)14(3418)17(27)315)10769(293)811(10)25(20)19(28)21(2223)24h68H15H3
METHYL2(7METHOXY22DIMETHYL3THIOXO1(222TRIFLUOROACETYL)(412DIHYDROQUINOLYLIDENE))5(METHOXYCARBONYL)13DITHIOLENE4CARBOXYLATE
MFCD00689684
ZINC000004119471
ZINC04119471
ZINC4119471
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