Vitas-M small molecule compound
methyl N-(ethoxycarbonyl)-3,3,3-trifluoro-2-(pyrimidin-2-ylamino)alaninate
Catalog ID
STL312834
SMILES CCOC(=O)NC(C(F)(F)F)(C(=O)OC)Nc1ncccn1
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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 C11H13F3N4O4 MW 322.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H13F3N4O4/c1-3-22-9(20)18-10(7(19)21-2,11(12,13)14)17-8-15-5-4-6-16-8/h4-6H,3H2,1-2H3,(H,18,20)(H,15,16,17)InChIKey
XGPAPONNNSZNTD-UHFFFAOYSA-NSynonyms
1441904-08-0(R)methyl2((ethoxycarbonyl)amino)333trifluoro2(pyrimidin2ylamino)propanoate
1441904080
CCOC(=O)NC(C(=O)OC)(C(F)(F)F)NC1=NC=CC=N1
InChI=1SC11H13F3N4O4c13229(20)1810(7(19)21211(1213)14)17815546168h46H3H212H3(H1820)(H151617)
methyl2(ethoxycarbonylamino)333trifluoro2(pyrimidin2ylamino)propanoate
methylN(ethoxycarbonyl)333trifluoro2(pyrimidin2ylamino)alaninate
MFCD22583541
ZINC000079482841
ZINC000079482846
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