Vitas-M small molecule compound
ethyl N-{[4-(3-ethoxy-1,1,1-trifluoro-2-hydroxy-3-oxopropan-2-yl)phenyl]carbamoyl}-3,3,3-trifluoro-2-(4-fluorophenoxy)alaninate
Catalog ID
STL563477
SMILES CCOC(=O)C(C(F)(F)F)(Oc1ccc(cc1)F)NC(=O)Nc1ccc(cc1)C(C(F)(F)F)(C(=O)OCC)O
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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 C23H21F7N2O7 MW 570.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21F7N2O7/c1-3-37-17(33)20(36,22(25,26)27)13-5-9-15(10-6-13)31-19(35)32-21(23(28,29)30,18(34)38-4-2)39-16-11-7-14(24)8-12-16/h5-12,36H,3-4H2,1-2H3,(H2,31,32,35)InChIKey
YHXSURLGOBSUON-UHFFFAOYSA-NSynonyms
4279079
ethyl2(4((3ethoxy111trifluoro2(4fluorophenoxy)3oxopropan2yl)carbamoylamino)phenyl)333trifluoro2hydroxypropanoate
ethyl2(4(3(3ethoxy111trifluoro2(4fluorophenoxy)3oxopropan2yl)ureido)phenyl)333trifluoro2hydroxypropanoate
ethylN((4(3ethoxy111trifluoro2hydroxy3oxopropan2yl)phenyl)carbamoyl)333trifluoro2(4fluorophenoxy)alaninate
InChI=1SC23H21F7N2O7c133717(33)20(3622(2526)27)135915(10613)3119(35)3221(23(2829)3018(34)3842)391611714(24)81216h51236H34H212H3(H2313235)
MFCD01556522
ZINC000103539919
ZINC000103539928
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