Vitas-M small molecule compound
ethyl N-[(2-ethoxyphenyl)carbonyl]-3,3,3-trifluoro-2-[(4-fluorophenyl)amino]alaninate
Catalog ID
STK690012
SMILES CCOC(=O)C(C(F)(F)F)(NC(=O)c1ccccc1OCC)Nc1ccc(cc1)F
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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 C20H20F4N2O4 MW 428.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20F4N2O4/c1-3-29-16-8-6-5-7-15(16)17(27)26-19(20(22,23)24,18(28)30-4-2)25-14-11-9-13(21)10-12-14/h5-12,25H,3-4H2,1-2H3,(H,26,27)InChIKey
XMQROMUHPZJWIQ-UHFFFAOYSA-NSynonyms
CCOC1=CC=CC=C1C(=O)NC(C(=O)OCC)(C(F)(F)F)NC2=CC=C(C=C2)F
ethyl2((2ethoxybenzoyl)amino)333trifluoro2(4fluoroanilino)propanoate
ethylN((2ethoxyphenyl)carbonyl)333trifluoro2((4fluorophenyl)amino)alaninate
InChI=1SC20H20F4N2O4c132916865715(16)17(27)2619(20(2223)2418(28)3042)251411913(21)101214h51225H34H212H3(H2627)
MFCD00789282
ZINC000003103565
ZINC000003103566
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