Vitas-M small molecule compound

4-{(E)-[2-({1-(4-amino-1,2,5-oxadiazol-3-yl)-5-[(diethylammonio)methyl]-1H-1,2,3-triazol-4-yl}carbonyl)hydrazinylidene]methyl}-2,6-di-tert-butylphenolate

Catalog ID
STK563233
SMILES CC[NH+](Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1cc(c(c(c1)C(C)(C)C)[O-])C(C)(C)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 C25H37N9O3 MW 511.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H37N9O3/c1-9-33(10-2)14-18-19(28-32-34(18)22-21(26)30-37-31-22)23(36)29-27-13-15-11-16(24(3,4)5)20(35)17(12-15)25(6,7)8/h11-13,35H,9-10,14H2,1-8H3,(H2,26,30)(H,29,36)/b27-13+
InChIKey
XIHJSTKDNGFQSW-UVHMKAGCSA-N
Synonyms
497941-26-1
497941261
CC(NH+)(Cc1c(nnn1c1nonc1N)C(=O)NN=Cc1cc(c(c(c1)C(C)(C)C)(O))C(C)(C)C)CC
MFCD02155273
ZINC000001781984

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Available files

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