Vitas-M small molecule compound
1-{2-[(2,4-dimethoxyphenyl)amino]-2-oxoethyl}-5-methyl-N-[3-(trifluoromethyl)phenyl]-1H-1,2,3-triazole-4-carboxamide
Catalog ID
STL142698
SMILES COc1ccc(c(c1)OC)NC(=O)Cn1nnc(c1C)C(=O)Nc1cccc(c1)C(F)(F)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 C21H20F3N5O4 MW 463.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20F3N5O4/c1-12-19(20(31)25-14-6-4-5-13(9-14)21(22,23)24)27-28-29(12)11-18(30)26-16-8-7-15(32-2)10-17(16)33-3/h4-10H,11H2,1-3H3,(H,25,31)(H,26,30)InChIKey
RKVFLCALRYMBQT-UHFFFAOYSA-NSynonyms
1(2((24dimethoxyphenyl)amino)2oxoethyl)5methylN(3(trifluoromethyl)phenyl)1H123triazole4carboxamide
1(2(24dimethoxyanilino)2oxoethyl)5methylN(3(trifluoromethyl)phenyl)triazole4carboxamide
CC1=C(N=NN1CC(=O)NC2=C(C=C(C=C2)OC)OC)C(=O)NC3=CC=CC(=C3)C(F)(F)F
InChI=1SC21H20F3N5O4c11219(20(31)251464513(914)21(2223)24)272829(12)1118(30)26168715(322)1017(16)333h410H11H213H3(H2531)(H2630)
MFCD20747310
ZINC000071327039
ZINC71327039
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