Vitas-M small molecule compound
4-[(E)-{2-[({5-[(4-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-4-ium-2-yl}sulfanyl)acetyl]hydrazinylidene}methyl]-2,6-dimethoxyphenolate
Catalog ID
STL150474
SMILES COc1cc(/C=N/NC(=O)CSc2n[nH+]c(s2)SCc2ccc(cc2)Cl)cc(c1[O-])OC
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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 C20H19ClN4O4S3 MW 511.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H19ClN4O4S3/c1-28-15-7-13(8-16(29-2)18(15)27)9-22-23-17(26)11-31-20-25-24-19(32-20)30-10-12-3-5-14(21)6-4-12/h3-9,27H,10-11H2,1-2H3,(H,23,26)/b22-9+InChIKey
UHOUCJBGSNMZDF-LSFURLLWSA-NSynonyms
327974-50-5327974505
COc1cc(C=NNC(=O)CSc2n(nH+)c(s2)SCc2ccc(cc2)Cl)cc(c1(O))OC
MFCD02710829
ZINC000002332883
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