Vitas-M small molecule compound

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

Catalog ID
STL040502
SMILES C[NH+](Cc1c(nnn1c1nonc1N)C(=O)N/N=C/c1cc(c(c(c1)C(C)(C)C)[O-])C(C)(C)C)C

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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 C23H33N9O3 MW 483.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H33N9O3/c1-22(2,3)14-9-13(10-15(18(14)33)23(4,5)6)11-25-27-21(34)17-16(12-31(7)8)32(30-26-17)20-19(24)28-35-29-20/h9-11,33H,12H2,1-8H3,(H2,24,28)(H,27,34)/b25-11+
InChIKey
YNJXZINHPHOZAX-OPEKNORGSA-N
Synonyms
840484-32-4
840484324
C(NH+)(Cc1c(nnn1c1nonc1N)C(=O)NN=Cc1cc(c(c(c1)C(C)(C)C)(O))C(C)(C)C)C
MFCD03339455
ZINC000001871049

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Available files

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