Vitas-M small molecule compound
2-({4-bromo-2-[(Z)-(1-methyl-5-oxo-2-thioxoimidazolidin-4-ylidene)methyl]phenoxy}methyl)benzonitrile
Catalog ID
STL368911
SMILES N#Cc1ccccc1COc1ccc(cc1/C=C/1\NC(=S)N(C1=O)C)Br
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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 C19H14BrN3O2S MW 428.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H14BrN3O2S/c1-23-18(24)16(22-19(23)26)9-14-8-15(20)6-7-17(14)25-11-13-5-3-2-4-12(13)10-21/h2-9H,11H2,1H3,(H,22,26)/b16-9-InChIKey
NSQQPRLGIOERJI-SXGWCWSVSA-NSynonyms
2((4BROMO2((Z)(1METHYL5OXO2SULFANYLIDENEIMIDAZOLIDIN4YLIDENE)METHYL)PHENOXY)METHYL)BENZONITRILE
2((4bromo2((Z)(1methyl5oxo2thioxoimidazolidin4ylidene)methyl)phenoxy)methyl)benzonitrile
CN1C(=O)C(=CC2=C(C=CC(=C2)Br)OCC3=CC=CC=C3C#N)NC1=S
InChI=1SC19H14BrN3O2Sc12318(24)16(2219(23)26)914815(20)6717(14)251113532412(13)1021h29H11H21H3(H2226)b169
MFCD03082566
N#Cc1ccccc1COc1ccc(cc1C=C1NC(=S)N(C1=O)C)Br
ZINC000009295841
ZINC09295841
ZINC9295841
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