Vitas-M small molecule compound

4-[(E)-{2-[({5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-4-ium-2-yl}sulfanyl)acetyl]hydrazinylidene}methyl]phenolate

Catalog ID
STL037455
SMILES O=C(CSc1n[nH+]c(s1)SCc1ccc(cc1)C)N/N=C/c1ccc(cc1)[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 C19H18N4O2S3 MW 430.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N4O2S3/c1-13-2-4-15(5-3-13)11-26-18-22-23-19(28-18)27-12-17(25)21-20-10-14-6-8-16(24)9-7-14/h2-10,24H,11-12H2,1H3,(H,21,25)/b20-10+
InChIKey
LCYHCIHTXVYOAG-KEBDBYFISA-N
Synonyms
488086-99-3
488086993
MFCD03219445
O=C(CSc1n(nH+)c(s1)SCc1ccc(cc1)C)NN=Cc1ccc(cc1)(O)
ZINC000002324844

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Available files

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