Vitas-M small molecule compound
4-bromo-2-[(E)-{2-[({5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-4-ium-2-yl}sulfanyl)acetyl]hydrazinylidene}methyl]phenolate
Catalog ID
STL043796
SMILES O=C(CSc1n[nH+]c(s1)SCc1ccc(cc1)C)N/N=C/c1cc(Br)ccc1[O-]
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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 C19H17BrN4O2S3 MW 509.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17BrN4O2S3/c1-12-2-4-13(5-3-12)10-27-18-23-24-19(29-18)28-11-17(26)22-21-9-14-8-15(20)6-7-16(14)25/h2-9,25H,10-11H2,1H3,(H,22,26)/b21-9+InChIKey
CFFYEUXJMJINHM-ZVBGSRNCSA-NSynonyms
488101-65-1488101651
MFCD03219471
O=C(CSc1n(nH+)c(s1)SCc1ccc(cc1)C)NN=Cc1cc(Br)ccc1(O)
ZINC000002327361
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