Vitas-M small molecule compound
ethyl 2-(butylamino)-4-({[3-cyano-4-cyclopropyl-6-(difluoromethyl)pyridin-2-yl]sulfanyl}methyl)-1,3-thiazole-5-carboxylate
Catalog ID
STL175378
SMILES CCCCNc1sc(c(n1)CSc1nc(cc(c1C#N)C1CC1)C(F)F)C(=O)OCC
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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 C21H24F2N4O2S2 MW 466.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24F2N4O2S2/c1-3-5-8-25-21-27-16(17(31-21)20(28)29-4-2)11-30-19-14(10-24)13(12-6-7-12)9-15(26-19)18(22)23/h9,12,18H,3-8,11H2,1-2H3,(H,25,27)InChIKey
PZEKLRLEGVMYAP-UHFFFAOYSA-NSynonyms
938009-35-9938009359
CCCCNC1=NC(=C(S1)C(=O)OCC)CSC2=C(C(=CC(=N2)C(F)F)C3CC3)C#N
ethyl2(butylamino)4(((3cyano4cyclopropyl6(difluoromethyl)pyridin2yl)sulfanyl)methyl)13thiazole5carboxylate
ethyl2(butylamino)4((3cyano4cyclopropyl6(difluoromethyl)pyridin2yl)sulfanylmethyl)13thiazole5carboxylate
InChI=1SC21H24F2N4O2S2c135825212716(17(3121)20(28)2942)11301914(1024)13(126712)915(2619)18(22)23h91218H3811H212H3(H2527)
MFCD08553844
ZINC000020607628
ZINC20607628
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