Vitas-M small molecule compound

3-[(1E)-1-(2-{[1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-(1,3-benzodioxol-5-yl)-1H-1,2,3-triazol-4-yl]carbonyl}hydrazinylidene)ethyl]phenolate

Catalog ID
STK568696
SMILES [O-]c1cccc(c1)/C(=N/NC(=O)c1nnn(c1c1ccc2c(c1)OCO2)c1nonc1[NH3+])/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 C20H16N8O5 MW 448.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16N8O5/c1-10(11-3-2-4-13(29)7-11)22-24-20(30)16-17(12-5-6-14-15(8-12)32-9-31-14)28(27-23-16)19-18(21)25-33-26-19/h2-8,29H,9H2,1H3,(H2,21,25)(H,24,30)/b22-10+
InChIKey
CDORJWDWJQJFEF-LSHDLFTRSA-N
Synonyms
861139-86-8
(O)c1cccc(c1)C(=NNC(=O)c1nnn(c1c1ccc2c(c1)OCO2)c1nonc1(NH3+))C
861139868
MFCD05683869
ZINC000009308011

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Available files

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