Vitas-M small molecule compound
4,4'-(1,2,3-thiadiazol-4-ylmethanediyl)bis{2-[4-(ethoxycarbonyl)-1,3-thiazol-2-yl]-3-oxo-5-(trifluoromethyl)-2,3-dihydropyrazol-1-ide}
Catalog ID
STL439608
SMILES CCOC(=O)c1csc(n1)n1[n-]c(c(c1=O)C(c1c(=O)n([n-]c1C(F)(F)F)c1scc(n1)C(=O)OCC)c1csnn1)C(F)(F)F
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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 C23H14F6N8O6S3 MW 708.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H16F6N8O6S3/c1-3-42-18(40)9-5-44-20(30-9)36-16(38)12(14(33-36)22(24,25)26)11(8-7-46-35-32-8)13-15(23(27,28)29)34-37(17(13)39)21-31-10(6-45-21)19(41)43-4-2/h5-7,11H,3-4H2,1-2H3,(H2,33,34,38,39)/p-2InChIKey
YJOODFRXIYNNJA-UHFFFAOYSA-LSynonyms
44(123thiadiazol4ylmethanediyl)bis(2(4(ethoxycarbonyl)13thiazol2yl)3oxo5(trifluoromethyl)23dihydropyrazol1ide)
CCOC(=O)c1csc(n1)n1(n)c(c(c1=O)C(c1c(=O)n((n)c1C(F)(F)F)c1scc(n1)C(=O)OCC)c1csnn1)C(F)(F)F
ZINC000150346850
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