Vitas-M small molecule compound
2,6-dimethoxy-4-[(E)-{[3-(2-methylphenyl)-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl]imino}methyl]phenyl acetate
Catalog ID
STL149222
SMILES COc1cc(/C=N/n2c(=S)[nH]nc2c2ccccc2C)cc(c1OC(=O)C)OC
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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 C20H20N4O4S MW 412.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20N4O4S/c1-12-7-5-6-8-15(12)19-22-23-20(29)24(19)21-11-14-9-16(26-3)18(28-13(2)25)17(10-14)27-4/h5-11H,1-4H3,(H,23,29)/b21-11+InChIKey
VDRYWVNSCWVGLN-SRZZPIQSSA-NSynonyms
500272-91-3500272913
COc1cc(C=Nn2c(=S)(nH)nc2c2ccccc2C)cc(c1OC(=O)C)OC
MFCD03808713
ZINC000001308387
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