Vitas-M small molecule compound
2-[(E)-(2-{[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-(4-nitrophenyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]benzoate
Catalog ID
STL052917
SMILES O=C(c1nnn(c1c1ccc(cc1)[N+](=O)[O-])c1nonc1[NH3+])N/N=C/c1ccccc1C(=O)[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 C19H13N9O6 MW 463.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13N9O6/c20-16-17(25-34-24-16)27-15(10-5-7-12(8-6-10)28(32)33)14(22-26-27)18(29)23-21-9-11-3-1-2-4-13(11)19(30)31/h1-9H,(H2,20,24)(H,23,29)(H,30,31)/b21-9+InChIKey
BQFSTLXNXCKISS-ZVBGSRNCSA-NSynonyms
586990-78-5586990785
MFCD04031168
O=C(c1nnn(c1c1ccc(cc1)(N+)(=O)(O))c1nonc1(NH3+))NN=Cc1ccccc1C(=O)(O)
ZINC000002394136
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