Vitas-M small molecule compound
(2E)-2-cyano-3-(3,5-dibromo-4-hydroxyphenyl)-N-(propan-2-yl)prop-2-enamide
Catalog ID
STK362417
SMILES CC(NC(=O)/C(=C/c1cc(Br)c(c(c1)Br)O)/C#N)C
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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 C13H12Br2N2O2 MW 388.06 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H12Br2N2O2/c1-7(2)17-13(19)9(6-16)3-8-4-10(14)12(18)11(15)5-8/h3-5,7,18H,1-2H3,(H,17,19)/b9-3+InChIKey
ZUNOHDAMQYAYDY-YCRREMRBSA-NSynonyms
(2E)2CYANO3(35DIBROMO4HYDROXYPHENYL)N(PROPAN2YL)PROP2ENAMIDE
(E)2CYANO3(35DIBROMO4HYDROXYPHENYL)NPROPAN2YLPROP2ENAMIDE
CC(C)NC(=O)C(=CC1=CC(=C(C(=C1)Br)O)Br)C#N
CC(NC(=O)C(=Cc1cc(Br)c(c(c1)Br)O)C#N)C
InChI=1SC13H12Br2N2O2c17(2)1713(19)9(616)38410(14)12(18)11(15)58h35718H12H3(H1719)b93+
MFCD11852876
ZINC000006358291
ZINC06358291
ZINC6358291
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