Vitas-M small molecule compound
(2E)-3-(5-bromo-2-butoxyphenyl)-2-cyano-N-(propan-2-yl)prop-2-enamide
Catalog ID
STK435903
SMILES CCCCOc1ccc(cc1/C=C(/C(=O)NC(C)C)\C#N)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 C17H21BrN2O2 MW 365.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21BrN2O2/c1-4-5-8-22-16-7-6-15(18)10-13(16)9-14(11-19)17(21)20-12(2)3/h6-7,9-10,12H,4-5,8H2,1-3H3,(H,20,21)/b14-9+InChIKey
VHILAXKNZKMDKT-NTEUORMPSA-NSynonyms
(2E)3(5BROMO2BUTOXYPHENYL)2CYANON(METHYLETHYL)PROP2ENAMIDE
(2E)3(5bromo2butoxyphenyl)2cyanoN(propan2yl)prop2enamide
(E)3(5BROMO2BUTOXYPHENYL)2CYANONPROPAN2YLPROP2ENAMIDE
CCCCOC1=C(C=C(C=C1)Br)C=C(C#N)C(=O)NC(C)C
CCCCOc1ccc(cc1C=C(C(=O)NC(C)C)C#N)Br
InChI=1SC17H21BrN2O2c145822167615(18)1013(16)914(1119)17(21)2012(2)3h6791012H458H213H3(H2021)b149+
MFCD04054415
ZINC000017075019
ZINC17075019
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