Vitas-M small molecule compound
diethyl 1-{2-[(3-chloro-4-methylphenyl)amino]-2-oxoethyl}-1H-1,2,3-triazole-4,5-dicarboxylate
Catalog ID
STL094525
SMILES CCOC(=O)c1n(nnc1C(=O)OCC)CC(=O)Nc1ccc(c(c1)Cl)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 C17H19ClN4O5 MW 394.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H19ClN4O5/c1-4-26-16(24)14-15(17(25)27-5-2)22(21-20-14)9-13(23)19-11-7-6-10(3)12(18)8-11/h6-8H,4-5,9H2,1-3H3,(H,19,23)InChIKey
QWSRUYVPIICQQO-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(N(N=N1)CC(=O)NC2=CC(=C(C=C2)C)Cl)C(=O)OCC
diethyl1(2((3chloro4methylphenyl)amino)2oxoethyl)1H123triazole45dicarboxylate
diethyl1(2(3chloro4methylanilino)2oxoethyl)triazole45dicarboxylate
InChI=1SC17H19ClN4O5c142616(24)1415(17(25)2752)22(212014)913(23)19117610(3)12(18)811h68H459H213H3(H1923)
MFCD14726154
ZINC000004878131
ZINC4878131
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