Vitas-M small molecule compound
4-{(E)-[(3-{[(3,5-dimethyl-4-nitro-1H-pyrazol-1-yl)methyl]sulfanyl}-5-methyl-4H-1,2,4-triazol-4-yl)imino]methyl}-2-ethoxyphenol
Catalog ID
STL399254
SMILES CCOc1cc(/C=N/n2c(C)nnc2SCn2nc(c(c2C)[N+](=O)[O-])C)ccc1O
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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 C18H21N7O4S MW 431.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H21N7O4S/c1-5-29-16-8-14(6-7-15(16)26)9-19-24-13(4)20-21-18(24)30-10-23-12(3)17(25(27)28)11(2)22-23/h6-9,26H,5,10H2,1-4H3/b19-9+InChIKey
WEGCAOXNEWHRPY-DJKKODMXSA-NSynonyms
1005615-56-41005615564
4((E)((3(((35dimethyl4nitro1Hpyrazol1yl)methyl)sulfanyl)5methyl4H124triazol4yl)imino)methyl)2ethoxyphenol
CCOc1cc(C=Nn2c(C)nnc2SCn2nc(c(c2C)(N+)(=O)(O))C)ccc1O
MFCD05667569
ZINC000002733221
Check stock
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