Vitas-M small molecule compound
diethyl 1-{2-[(3,4-dimethylphenyl)amino]-2-oxoethyl}-1H-1,2,3-triazole-4,5-dicarboxylate
Catalog ID
STL081305
SMILES CCOC(=O)c1n(nnc1C(=O)OCC)CC(=O)Nc1ccc(c(c1)C)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 C18H22N4O5 MW 374.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22N4O5/c1-5-26-17(24)15-16(18(25)27-6-2)22(21-20-15)10-14(23)19-13-8-7-11(3)12(4)9-13/h7-9H,5-6,10H2,1-4H3,(H,19,23)InChIKey
KXABRAOHGBYDHB-UHFFFAOYSA-NSynonyms
CCOC(=O)C1=C(N(N=N1)CC(=O)NC2=CC(=C(C=C2)C)C)C(=O)OCC
diethyl1(2((34dimethylphenyl)amino)2oxoethyl)1H123triazole45dicarboxylate
diethyl1(2(34dimethylanilino)2oxoethyl)triazole45dicarboxylate
InChI=1SC18H22N4O5c152617(24)1516(18(25)2762)22(212015)1014(23)19138711(3)12(4)913h79H5610H214H3(H1923)
MFCD14749670
ZINC000004969612
ZINC04969612
ZINC4969612
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