Vitas-M small molecule compound
4-{(1E)-1-[2-({1-(4-ammonio-1,2,5-oxadiazol-3-yl)-5-[(phenylsulfanyl)methyl]-1H-1,2,3-triazol-4-yl}carbonyl)hydrazinylidene]ethyl}phenolate
Catalog ID
STL041798
SMILES [O-]c1ccc(cc1)/C(=N/NC(=O)c1nnn(c1CSc1ccccc1)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 C20H18N8O3S MW 450.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N8O3S/c1-12(13-7-9-14(29)10-8-13)22-24-20(30)17-16(11-32-15-5-3-2-4-6-15)28(27-23-17)19-18(21)25-31-26-19/h2-10,29H,11H2,1H3,(H2,21,25)(H,24,30)/b22-12+InChIKey
PKBLOUSRXSDVCF-WSDLNYQXSA-NSynonyms
579444-05-6(O)c1ccc(cc1)C(=NNC(=O)c1nnn(c1CSc1ccccc1)c1nonc1(NH3+))C
579444056
MFCD04032871
ZINC000009191222
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.