Vitas-M small molecule compound
ethyl 4-[({[5-(5-bromo-2-hydroxyphenyl)-4-ethyl-4H-1,2,4-triazol-3-yl]sulfanyl}acetyl)amino]benzoate
Catalog ID
STL359623
SMILES CCOC(=O)c1ccc(cc1)NC(=O)CSc1nnc(n1CC)c1cc(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 C21H21BrN4O4S MW 505.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21BrN4O4S/c1-3-26-19(16-11-14(22)7-10-17(16)27)24-25-21(26)31-12-18(28)23-15-8-5-13(6-9-15)20(29)30-4-2/h5-11,27H,3-4,12H2,1-2H3,(H,23,28)InChIKey
ZCSWWVQVJQFQIM-UHFFFAOYSA-NSynonyms
717861-42-2717861422
ethyl4((((5(5bromo2hydroxyphenyl)4ethyl4H124triazol3yl)sulfanyl)acetyl)amino)benzoate
MFCD06002643
ZINC000001078971
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