Vitas-M small molecule compound

(2E)-3-(5-bromofuran-2-yl)-2-cyano-N-(furan-2-ylmethyl)prop-2-enamide

Catalog ID
STK185099
SMILES N#C/C(=C\c1ccc(o1)Br)/C(=O)NCc1ccco1

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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 C13H9BrN2O3 MW 321.13 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H9BrN2O3/c14-12-4-3-10(19-12)6-9(7-15)13(17)16-8-11-2-1-5-18-11/h1-6H,8H2,(H,16,17)/b9-6+
InChIKey
TVGQEAWRXIHJFG-RMKNXTFCSA-N
Synonyms

(2E)3(5BROMOFURAN2YL)2CYANON(FURAN2YLMETHYL)PROP2ENAMIDE
(E)3(5BROMOFURAN2YL)2CYANON(FURAN2YLMETHYL)PROP2ENAMIDE
C1=COC(=C1)CNC(=O)C(=CC2=CC=C(O2)Br)C#N
InChI=1SC13H9BrN2O3c14124310(1912)69(715)13(17)168112151811h16H8H2(H1617)b96+
MFCD02044231
N#CC(=Cc1ccc(o1)Br)C(=O)NCc1ccco1
ZINC000004723442
ZINC04723442
ZINC4723442

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.