Vitas-M small molecule compound
methyl 5-[({[5-(5-bromo-2-hydroxyphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]-2-chlorobenzoate
Catalog ID
STL297379
SMILES C=CCn1c(SCC(=O)Nc2ccc(c(c2)C(=O)OC)Cl)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 C21H18BrClN4O4S MW 537.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18BrClN4O4S/c1-3-8-27-19(15-9-12(22)4-7-17(15)28)25-26-21(27)32-11-18(29)24-13-5-6-16(23)14(10-13)20(30)31-2/h3-7,9-10,28H,1,8,11H2,2H3,(H,24,29)InChIKey
WVKFVERPAZFPKK-UHFFFAOYSA-NSynonyms
708220-05-7708220057
methyl5((((5(5bromo2hydroxyphenyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)acetyl)amino)2chlorobenzoate
MFCD05990857
ZINC000002856966
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