Vitas-M small molecule compound
dimethyl 2-[({[5-(5-bromo-2-hydroxyphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzene-1,4-dicarboxylate
Catalog ID
STL354732
SMILES C=CCn1c(SCC(=O)Nc2cc(ccc2C(=O)OC)C(=O)OC)nnc1c1cc(Br)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 C23H21BrN4O6S MW 561.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21BrN4O6S/c1-4-9-28-20(16-11-14(24)6-8-18(16)29)26-27-23(28)35-12-19(30)25-17-10-13(21(31)33-2)5-7-15(17)22(32)34-3/h4-8,10-11,29H,1,9,12H2,2-3H3,(H,25,30)InChIKey
LMAQJAJVMUQLPZ-UHFFFAOYSA-NSynonyms
dimethyl2((((5(5bromo2hydroxyphenyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)acetyl)amino)benzene14dicarboxylate
MFCD06628670
ZINC000002881853
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