Vitas-M small molecule compound

2-[(E)-(2-{[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-(4-methylphenyl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)methyl]-4-chlorophenolate

Catalog ID
STL048371
SMILES Cc1ccc(cc1)c1c(nnn1c1nonc1[NH3+])C(=O)N/N=C/c1cc(Cl)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 C19H15ClN8O3 MW 438.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H15ClN8O3/c1-10-2-4-11(5-3-10)16-15(23-27-28(16)18-17(21)25-31-26-18)19(30)24-22-9-12-8-13(20)6-7-14(12)29/h2-9,29H,1H3,(H2,21,25)(H,24,30)/b22-9+
InChIKey
KECUERUAFAWESX-LSFURLLWSA-N
Synonyms
840482-49-7
840482497
Cc1ccc(cc1)c1c(nnn1c1nonc1(NH3+))C(=O)NN=Cc1cc(Cl)ccc1(O)
MFCD04007018
ZINC000002264247

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.