Vitas-M small molecule compound
dimethyl 1-[2-(1,3-benzodioxol-5-ylamino)-2-oxoethyl]-1H-1,2,3-triazole-4,5-dicarboxylate
Catalog ID
STL094453
SMILES COC(=O)c1n(nnc1C(=O)OC)CC(=O)Nc1ccc2c(c1)OCO2
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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 C15H14N4O7 MW 362.30 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H14N4O7/c1-23-14(21)12-13(15(22)24-2)19(18-17-12)6-11(20)16-8-3-4-9-10(5-8)26-7-25-9/h3-5H,6-7H2,1-2H3,(H,16,20)InChIKey
FEPYWKWETVMRHZ-UHFFFAOYSA-NSynonyms
COC(=O)C1=C(N(N=N1)CC(=O)NC2=CC3=C(C=C2)OCO3)C(=O)OC
dimethyl1(2(13benzodioxol5ylamino)2oxoethyl)1H123triazole45dicarboxylate
DIMETHYL1(2(13BENZODIOXOL5YLAMINO)2OXOETHYL)TRIAZOLE45DICARBOXYLATE
InChI=1SC15H14N4O7c12314(21)1213(15(22)242)19(181712)611(20)16834910(58)267259h35H67H212H3(H1620)
MFCD14749647
ZINC000020182500
ZINC20182500
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