Vitas-M small molecule compound
2-{[5-(5-bromo-2-hydroxyphenyl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}-N-(4-methyl-3-nitrophenyl)acetamide
Catalog ID
STL297364
SMILES C=CCn1c(SCC(=O)Nc2ccc(c(c2)[N+](=O)[O-])C)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 C20H18BrN5O4S MW 504.36 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18BrN5O4S/c1-3-8-25-19(15-9-13(21)5-7-17(15)27)23-24-20(25)31-11-18(28)22-14-6-4-12(2)16(10-14)26(29)30/h3-7,9-10,27H,1,8,11H2,2H3,(H,22,28)InChIKey
DKJKXUPGKVKOMM-UHFFFAOYSA-NSynonyms
708216-45-92((5(5bromo2hydroxyphenyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)N(4methyl3nitrophenyl)acetamide
708216459
C=CCn1c(SCC(=O)Nc2ccc(c(c2)(N+)(=O)(O))C)nnc1c1cc(Br)ccc1O
MFCD05815903
ZINC000001121264
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