Vitas-M small molecule compound
ethyl 4-({[3-cyano-4-(1-ethyl-3-methyl-1H-pyrazol-4-yl)-6-(trifluoromethyl)pyridin-2-yl]sulfanyl}methyl)-5-methyl-1,2-oxazole-3-carboxylate
Catalog ID
STL386964
SMILES CCOC(=O)c1noc(c1CSc1nc(cc(c1C#N)c1cn(nc1C)CC)C(F)(F)F)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 C21H20F3N5O3S MW 479.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20F3N5O3S/c1-5-29-9-15(11(3)27-29)13-7-17(21(22,23)24)26-19(14(13)8-25)33-10-16-12(4)32-28-18(16)20(30)31-6-2/h7,9H,5-6,10H2,1-4H3InChIKey
UEMMDCHGHYTCOF-UHFFFAOYSA-NSynonyms
1006357-39-61006357396
CCN1C=C(C(=N1)C)C2=CC(=NC(=C2C#N)SCC3=C(ON=C3C(=O)OCC)C)C(F)(F)F
ETHYL4(((3CYANO4(1ETHYL3METHYL1HPYRAZOL4YL)6(TRIFLUOROMETHYL)PYRIDIN2YL)SULFANYL)METHYL)5METHYL12OXAZOLE3CARBOXYLATE
ethyl4((3cyano4(1ethyl3methylpyrazol4yl)6(trifluoromethyl)pyridin2yl)sulfanylmethyl)5methyl12oxazole3carboxylate
InChI=1SC21H20F3N5O3Sc1529915(11(3)2729)13717(21(2223)24)2619(14(13)825)33101612(4)322818(16)20(30)3162h79H5610H214H3
MFCD08553718
ZINC000013641010
ZINC13641010
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