Vitas-M small molecule compound

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

Catalog ID
STK567221
SMILES O=C(c1nnn(c1C(C)C)c1nonc1[NH3+])N/N=C/c1cc(c(c(c1)C(C)(C)C)[O-])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 C23H32N8O3 MW 468.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H32N8O3/c1-12(2)17-16(26-30-31(17)20-19(24)28-34-29-20)21(33)27-25-11-13-9-14(22(3,4)5)18(32)15(10-13)23(6,7)8/h9-12,32H,1-8H3,(H2,24,28)(H,27,33)/b25-11+
InChIKey
QZBXJZDVTITCIR-OPEKNORGSA-N
Synonyms
585563-85-5
585563855
MFCD04030874
O=C(c1nnn(c1C(C)C)c1nonc1(NH3+))NN=Cc1cc(c(c(c1)C(C)(C)C)(O))C(C)(C)C
ZINC000001873921

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Available files

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