Vitas-M small molecule compound
methyl 3-(acetylamino)-2-{(1E)-N-[2-(acetylamino)-1,1,1,3,3,3-hexafluoropropan-2-yl]ethanimidoyl}-4,4,4-trifluoro-3-(trifluoromethyl)butanoate
Catalog ID
STK691152
SMILES COC(=O)C(C(C(F)(F)F)(C(F)(F)F)NC(=O)C)/C(=N/C(C(F)(F)F)(C(F)(F)F)NC(=O)C)/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 C15H15F12N3O4 MW 529.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15F12N3O4/c1-5(28-11(14(22,23)24,15(25,26)27)30-7(3)32)8(9(33)34-4)10(12(16,17)18,13(19,20)21)29-6(2)31/h8H,1-4H3,(H,29,31)(H,30,32)/b28-5+InChIKey
BBTKREHFJVOCBZ-RSLIBCCBSA-NSynonyms
CC(=NC(C(F)(F)F)(C(F)(F)F)NC(=O)C)C(C(=O)OC)C(C(F)(F)F)(C(F)(F)F)NC(=O)C
COC(=O)C(C(C(F)(F)F)(C(F)(F)F)NC(=O)C)C(=NC(C(F)(F)F)(C(F)(F)F)NC(=O)C)C
InChI=1SC15H15F12N3O4c15(2811(14(2223)2415(2526)27)307(3)32)8(9(33)344)10(12(1617)1813(1920)21)296(2)31h8H14H3(H2931)(H3032)b285+
methyl3(acetylamino)2((1E)N(2(acetylamino)111333hexafluoropropan2yl)ethanimidoyl)444trifluoro3(trifluoromethyl)butanoate
methyl3acetamido2((E)N(2acetamido111333hexafluoropropan2yl)Cmethylcarbonimidoyl)444trifluoro3(trifluoromethyl)butanoate
MFCD09064172
ZINC000100229888
ZINC000100229891
Check stock
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Check stock on Vitas-MAvailable files
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