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-cyanophenyl)acetamide
Catalog ID
STL297384
SMILES C=CCn1c(SCC(=O)Nc2ccc(cc2)C#N)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 C20H16BrN5O2S MW 470.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16BrN5O2S/c1-2-9-26-19(16-10-14(21)5-8-17(16)27)24-25-20(26)29-12-18(28)23-15-6-3-13(11-22)4-7-15/h2-8,10,27H,1,9,12H2,(H,23,28)InChIKey
JKOKRLNFLAHSOY-UHFFFAOYSA-NSynonyms
701290-66-62((5(5bromo2hydroxyphenyl)4(prop2en1yl)4H124triazol3yl)sulfanyl)N(4cyanophenyl)acetamide
701290666
MFCD05989201
ZINC000002851697
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