Vitas-M small molecule compound
4-{[(E)-(2-chloro-5-nitrophenyl)methylidene]amino}-5-(3-methoxyphenyl)-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STK568149
SMILES COc1cccc(c1)c1n[nH]c(=S)n1/N=C/c1cc(ccc1Cl)[N+](=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 C16H12ClN5O3S MW 389.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H12ClN5O3S/c1-25-13-4-2-3-10(8-13)15-19-20-16(26)21(15)18-9-11-7-12(22(23)24)5-6-14(11)17/h2-9H,1H3,(H,20,26)/b18-9+InChIKey
BTNWKMONFWMLAZ-GIJQJNRQSA-NSynonyms
613249-38-0613249380
COc1cccc(c1)c1n(nH)c(=S)n1N=Cc1cc(ccc1Cl)(N+)(=O)(O)
MFCD05731423
ZINC000005704034
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