Vitas-M small molecule compound
4-{[(E)-(4-chloro-3-nitrophenyl)methylidene]amino}-5-(2-methoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STL053924
SMILES COc1ccccc1c1n[nH]c(=S)n1/N=C/c1ccc(c(c1)[N+](=O)[O-])Cl
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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 C16H12ClN5O3S MW 389.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12ClN5O3S/c1-25-14-5-3-2-4-11(14)15-19-20-16(26)21(15)18-9-10-6-7-12(17)13(8-10)22(23)24/h2-9H,1H3,(H,20,26)/b18-9+InChIKey
CVHXFTJUSAWTBD-GIJQJNRQSA-NSynonyms
478257-26-0478257260
COc1ccccc1c1n(nH)c(=S)n1N=Cc1ccc(c(c1)(N+)(=O)(O))Cl
MFCD05724751
ZINC000005704409
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