Vitas-M small molecule compound
2-hydroxy-5-[(E)-{2-[({5-[(4-methylbenzyl)sulfanyl]-1,3,4-thiadiazol-4-ium-2-yl}sulfanyl)acetyl]hydrazinylidene}methyl]phenolate
Catalog ID
STL037443
SMILES O=C(CSc1n[nH+]c(s1)SCc1ccc(cc1)C)N/N=C/c1ccc(c(c1)[O-])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 C19H18N4O3S3 MW 446.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H18N4O3S3/c1-12-2-4-13(5-3-12)10-27-18-22-23-19(29-18)28-11-17(26)21-20-9-14-6-7-15(24)16(25)8-14/h2-9,24-25H,10-11H2,1H3,(H,21,26)/b20-9+InChIKey
CMQOMOKHBQWYDY-AWQFTUOYSA-NSynonyms
488810-64-62hydroxy5((E)(2(((5((4methylbenzyl)sulfanyl)134thiadiazol4ium2yl)sulfanyl)acetyl)hydrazinylidene)methyl)phenolate
488810646
MFCD03219391
O=C(CSc1n(nH+)c(s1)SCc1ccc(cc1)C)NN=Cc1ccc(c(c1)(O))O
ZINC000002353341
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