Vitas-M small molecule compound

2-[(1Z)-1-{2-[({5-[(4-chlorobenzyl)sulfanyl]-1,3,4-thiadiazol-4-ium-2-yl}sulfanyl)acetyl]hydrazinylidene}ethyl]phenolate

Catalog ID
STK562477
SMILES O=C(CSc1n[nH+]c(s1)SCc1ccc(cc1)Cl)N/N=C(\c1ccccc1[O-])/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 C19H17ClN4O2S3 MW 465.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H17ClN4O2S3/c1-12(15-4-2-3-5-16(15)25)21-22-17(26)11-28-19-24-23-18(29-19)27-10-13-6-8-14(20)9-7-13/h2-9,25H,10-11H2,1H3,(H,22,26)/b21-12-
InChIKey
QWXOYHZRGPCAJQ-MTJSOVHGSA-N
Synonyms
406202-52-6
406202526
MFCD03680669
O=C(CSc1n(nH+)c(s1)SCc1ccc(cc1)Cl)NN=C(c1ccccc1(O))C
ZINC000009428444

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.