Vitas-M small molecule compound
diethyl 1-{1-[(2,6-dimethylphenyl)amino]-1-oxobutan-2-yl}-1H-1,2,3-triazole-4,5-dicarboxylate
Catalog ID
STL094749
SMILES CCOC(=O)c1c(nnn1C(C(=O)Nc1c(C)cccc1C)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 C20H26N4O5 MW 402.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H26N4O5/c1-6-14(18(25)21-15-12(4)10-9-11-13(15)5)24-17(20(27)29-8-3)16(22-23-24)19(26)28-7-2/h9-11,14H,6-8H2,1-5H3,(H,21,25)InChIKey
CIPMLNDAMIIOEQ-UHFFFAOYSA-NSynonyms
865656-91-3865656913
CCC(C(=O)NC1=C(C=CC=C1C)C)N2C(=C(N=N2)C(=O)OCC)C(=O)OCC
DIETHYL1((2R)1((26DIMETHYLPHENYL)AMINO)1OXOBUTAN2YL)1H123TRIAZOLE45DICARBOXYLATE
DIETHYL1(1(((26DIMETHYLPHENYL)AMINO)CARBONYL)PROPYL)1H123TRIAZOLE45DICARBOXYLATE
diethyl1(1((26dimethylphenyl)amino)1oxobutan2yl)1H123triazole45dicarboxylate
diethyl1(1(26dimethylanilino)1oxobutan2yl)triazole45dicarboxylate
InChI=1SC20H26N4O5c1614(18(25)211512(4)1091113(15)5)2417(20(27)2983)16(222324)19(26)2872h91114H68H215H3(H2125)
MFCD04444964
ZINC000002686866
ZINC000002686867
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