Vitas-M small molecule compound
1-(2-ethoxy-2-oxoethyl)-7-ethyl-6-methyl-1H-[1,2,4]triazolo[4,3-b]pyridazin-4-ium-8-olate
Catalog ID
STK667252
SMILES CCOC(=O)Cn1nc[n+]2c1c([O-])c(c(n2)C)CC
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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 C12H16N4O3 MW 264.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H16N4O3/c1-4-9-8(3)14-16-7-13-15(12(16)11(9)18)6-10(17)19-5-2/h7H,4-6H2,1-3H3InChIKey
UTPGVIGZFNVDNG-UHFFFAOYSA-NSynonyms
1(2ETHOXY2OXOETHYL)7ETHYL6METHYL(124)TRIAZOLO(43B)PYRIDAZIN4IUM8OLATE
1(2ethoxy2oxoethyl)7ethyl6methyl1H(124)triazolo(43b)pyridazin4ium8olate
CCC1=C(C2=(N+)(C=NN2CC(=O)OCC)N=C1C)(O)
CCOC(=O)Cn1nc(n+)2c1c((O))c(c(n2)C)CC
InChI=1SC12H16N4O3c1498(3)141671315(12(16)11(9)18)610(17)1952h7H46H213H3
MFCD00656297
ZINC000008826559
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