Vitas-M small molecule compound
ethyl 2-(butylamino)-4-({[3-cyano-4-methyl-6-(trifluoromethyl)pyridin-2-yl]sulfanyl}methyl)-1,3-thiazole-5-carboxylate
Catalog ID
STL175274
SMILES CCCCNc1sc(c(n1)CSc1nc(cc(c1C#N)C)C(F)(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 C19H21F3N4O2S2 MW 458.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H21F3N4O2S2/c1-4-6-7-24-18-25-13(15(30-18)17(27)28-5-2)10-29-16-12(9-23)11(3)8-14(26-16)19(20,21)22/h8H,4-7,10H2,1-3H3,(H,24,25)InChIKey
BIQVWAHKUAAGFC-UHFFFAOYSA-NSynonyms
938014-39-2938014392
CCCCNC1=NC(=C(S1)C(=O)OCC)CSC2=C(C(=CC(=N2)C(F)(F)F)C)C#N
ethyl2(butylamino)4(((3cyano4methyl6(trifluoromethyl)pyridin2yl)sulfanyl)methyl)13thiazole5carboxylate
ethyl2(butylamino)4((3cyano4methyl6(trifluoromethyl)pyridin2yl)sulfanylmethyl)13thiazole5carboxylate
InChI=1SC19H21F3N4O2S2c146724182513(15(3018)17(27)2852)10291612(923)11(3)814(2616)19(2021)22h8H4710H213H3(H2425)
MFCD08554864
ZINC000020607353
ZINC20607353
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