Vitas-M small molecule compound
ethyl 4-({[3-cyano-4-methyl-6-(trifluoromethyl)pyridin-2-yl]sulfanyl}methyl)-2-(prop-2-en-1-ylamino)-1,3-thiazole-5-carboxylate
Catalog ID
STL175276
SMILES C=CCNc1sc(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 C18H17F3N4O2S2 MW 442.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H17F3N4O2S2/c1-4-6-23-17-24-12(14(29-17)16(26)27-5-2)9-28-15-11(8-22)10(3)7-13(25-15)18(19,20)21/h4,7H,1,5-6,9H2,2-3H3,(H,23,24)InChIKey
PNYKGGMSLCSZDD-UHFFFAOYSA-NSynonyms
938009-31-5938009315
CCOC(=O)C1=C(N=C(S1)NCC=C)CSC2=C(C(=CC(=N2)C(F)(F)F)C)C#N
ethyl4(((3cyano4methyl6(trifluoromethyl)pyridin2yl)sulfanyl)methyl)2(prop2en1ylamino)13thiazole5carboxylate
ethyl4((3cyano4methyl6(trifluoromethyl)pyridin2yl)sulfanylmethyl)2(prop2enylamino)13thiazole5carboxylate
InChI=1SC18H17F3N4O2S2c14623172412(14(2917)16(26)2752)9281511(822)10(3)713(2515)18(1920)21h47H1569H223H3(H2324)
MFCD08553809
ZINC000020607357
ZINC20607357
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