Vitas-M small molecule compound
2-[(1Z)-1-{2-[({5-[(2-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-4-ium-2-yl}sulfanyl)acetyl]hydrazinylidene}ethyl]phenolate
Catalog ID
STK564339
SMILES O=C(N/N=C(\c1ccccc1[O-])/C)CSc1n[nH+]c(s1)SCc1ccccc1Cl
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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 C19H17ClN4O2S3 MW 465.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17ClN4O2S3/c1-12(14-7-3-5-9-16(14)25)21-22-17(26)11-28-19-24-23-18(29-19)27-10-13-6-2-4-8-15(13)20/h2-9,25H,10-11H2,1H3,(H,22,26)/b21-12-InChIKey
RQFONNHEXPVBGF-MTJSOVHGSA-NSynonyms
488727-14-62((1Z)1(2(((5((2chlorobenzyl)sulfanyl)134thiadiazol4ium2yl)sulfanyl)acetyl)hydrazinylidene)ethyl)phenolate
2((Z)N((2((5((2CHLOROPHENYL)METHYLSULFANYL)134THIADIAZOL4IUM2YL)SULFANYL)ACETYL)AMINO)CMETHYLCARBONIMIDOYL)PHENOLATE
488727146
InChI=1SC19H17ClN4O2S3c112(14735916(14)25)212217(26)112819242318(2919)271013624815(13)20h2925H1011H21H3(H2226)b2112
MFCD03291679
O=C(NN=C(c1ccccc1(O))C)CSc1n(nH+)c(s1)SCc1ccccc1Cl
ZINC000100845076
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