Vitas-M small molecule compound
4-bromo-2-[(E)-{2-[({5-[(naphthalen-1-ylmethyl)sulfanyl]-1,3,4-thiadiazol-4-ium-2-yl}sulfanyl)acetyl]hydrazinylidene}methyl]phenolate
Catalog ID
STL147616
SMILES O=C(CSc1n[nH+]c(s1)SCc1cccc2c1cccc2)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 C22H17BrN4O2S3 MW 545.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17BrN4O2S3/c23-17-8-9-19(28)16(10-17)11-24-25-20(29)13-31-22-27-26-21(32-22)30-12-15-6-3-5-14-4-1-2-7-18(14)15/h1-11,28H,12-13H2,(H,25,29)/b24-11+InChIKey
DUKGJEUJOMNCAH-BHGWPJFGSA-NSynonyms
497822-87-4497822874
MFCD03219282
O=C(CSc1n(nH+)c(s1)SCc1cccc2c1cccc2)NN=Cc1cc(Br)ccc1(O)
ZINC000100852822
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