Vitas-M small molecule compound
diethyl 1-{1-[(2-methoxy-5-methylphenyl)amino]-1-oxobutan-2-yl}-1H-1,2,3-triazole-4,5-dicarboxylate
Catalog ID
STL094779
SMILES CCOC(=O)c1c(nnn1C(C(=O)Nc1cc(C)ccc1OC)CC)C(=O)OCC
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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 C20H26N4O6 MW 418.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26N4O6/c1-6-14(18(25)21-13-11-12(4)9-10-15(13)28-5)24-17(20(27)30-8-3)16(22-23-24)19(26)29-7-2/h9-11,14H,6-8H2,1-5H3,(H,21,25)InChIKey
NNXPJWDNCAKJIJ-UHFFFAOYSA-NSynonyms
CCC(C(=O)NC1=C(C=CC(=C1)C)OC)N2C(=C(N=N2)C(=O)OCC)C(=O)OCC
DIETHYL1(1(((2METHOXY5METHYLPHENYL)AMINO)CARBONYL)PROPYL)1H123TRIAZOLE45DICARBOXYLATE
diethyl1(1((2methoxy5methylphenyl)amino)1oxobutan2yl)1H123triazole45dicarboxylate
DIETHYL1(1(2METHOXY5METHYLANILINO)1OXOBUTAN2YL)TRIAZOLE45DICARBOXYLATE
InChI=1SC20H26N4O6c1614(18(25)21131112(4)91015(13)285)2417(20(27)3083)16(222324)19(26)2972h91114H68H215H3(H2125)
MFCD14749700
ZINC000004111520
ZINC000004111521
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