Vitas-M small molecule compound
ethyl 3,3,3-trifluoro-N-(phenylcarbonyl)-2-(4H-1,2,4-triazol-4-ylamino)alaninate
Catalog ID
STL000071
SMILES CCOC(=O)C(C(F)(F)F)(NC(=O)c1ccccc1)Nn1cnnc1
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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 C14H14F3N5O3 MW 357.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H14F3N5O3/c1-2-25-12(24)13(14(15,16)17,21-22-8-18-19-9-22)20-11(23)10-6-4-3-5-7-10/h3-9,21H,2H2,1H3,(H,20,23)InChIKey
XOTJLBYTKXNDTH-UHFFFAOYSA-NSynonyms
298685-90-2298685902
CCOC(=O)C(C(F)(F)F)(NC(=O)C1=CC=CC=C1)NN2C=NN=C2
ethyl2((4H124triazol4yl)amino)2benzamido333trifluoropropanoate
ETHYL2(BENZOYLAMINO)333TRIFLUORON4H124TRIAZOL4YLDALANINATE
ETHYL2BENZAMIDO333TRIFLUORO2(124TRIAZOL4YLAMINO)PROPANOATE
ETHYL333TRIFLUORO2((PHENYLCARBONYL)AMINO)N4H124TRIAZOL4YLALANINATE
ethyl333trifluoroN(phenylcarbonyl)2(4H124triazol4ylamino)alaninate
InChI=1SC14H14F3N5O3c122512(24)13(14(1516)17212281819922)2011(23)106435710h3921H2H21H3(H2023)
MFCD02110190
ZINC000002421039
ZINC000002421040
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