Vitas-M small molecule compound
2-[(E)-(2-{[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-propyl-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]-4-bromophenolate
Catalog ID
STL051794
SMILES CCCc1c(nnn1c1nonc1[NH3+])C(=O)N/N=C/c1cc(Br)ccc1[O-]
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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 C15H15BrN8O3 MW 435.24 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H15BrN8O3/c1-2-3-10-12(19-23-24(10)14-13(17)21-27-22-14)15(26)20-18-7-8-6-9(16)4-5-11(8)25/h4-7,25H,2-3H2,1H3,(H2,17,21)(H,20,26)/b18-7+InChIKey
JJZIEEJVBNVVAL-CNHKJKLMSA-NSynonyms
848988-19-2848988192
CCCc1c(nnn1c1nonc1(NH3+))C(=O)NN=Cc1cc(Br)ccc1(O)
MFCD05678685
ZINC000001900750
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