Vitas-M small molecule compound
methyl N-acetyl-2-({4-[chloro(difluoro)methoxy]phenyl}amino)-3,3,3-trifluoroalaninate
Catalog ID
STK764936
SMILES COC(=O)C(C(F)(F)F)(Nc1ccc(cc1)OC(Cl)(F)F)NC(=O)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 C13H12ClF5N2O4 MW 390.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12ClF5N2O4/c1-7(22)20-11(10(23)24-2,12(15,16)17)21-8-3-5-9(6-4-8)25-13(14,18)19/h3-6,21H,1-2H3,(H,20,22)InChIKey
MSFHLNCVURDBHW-UHFFFAOYSA-NSynonyms
CC(=O)NC(C(=O)OC)(C(F)(F)F)NC1=CC=C(C=C1)OC(F)(F)Cl
InChI=1SC13H12ClF5N2O4c17(22)2011(10(23)24212(1516)17)218359(648)2513(1418)19h3621H12H3(H2022)
METHYL2(ACETYLAMINO)N(4(CHLORO(DIFLUORO)METHOXY)PHENYL)333TRIFLUOROALANINATE
METHYL2ACETAMIDO2(4(CHLORO(DIFLUORO)METHOXY)ANILINO)333TRIFLUOROPROPANOATE
methylNacetyl2((4(chloro(difluoro)methoxy)phenyl)amino)333trifluoroalaninate
MFCD02933370
ZINC000004543871
ZINC000004543874
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