Vitas-M small molecule compound

(2E)-3-(3-bromo-4-hydroxy-5-methoxyphenyl)-2-cyano-N-(propan-2-yl)prop-2-enamide

Catalog ID
STK075374
SMILES N#C/C(=C\c1cc(Br)c(c(c1)OC)O)/C(=O)NC(C)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 C14H15BrN2O3 MW 339.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H15BrN2O3/c1-8(2)17-14(19)10(7-16)4-9-5-11(15)13(18)12(6-9)20-3/h4-6,8,18H,1-3H3,(H,17,19)/b10-4+
InChIKey
VBHNSMYHJMFPQO-ONNFQVAWSA-N
Synonyms

(2E)3(3BROMO4HYDROXY5METHOXYPHENYL)2CYANON(PROPAN2YL)PROP2ENAMIDE
(E)3(3BROMO4HYDROXY5METHOXYPHENYL)2CYANONPROPAN2YLPROP2ENAMIDE
CC(C)NC(=O)C(=CC1=CC(=C(C(=C1)Br)O)OC)C#N
InChI=1SC14H15BrN2O3c18(2)1714(19)10(716)49511(15)13(18)12(69)203h46818H13H3(H1719)b104+
MFCD04669435
N#CC(=Cc1cc(Br)c(c(c1)OC)O)C(=O)NC(C)C
STK075374
ZINC000003570618
ZINC03570618
ZINC3570618

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Available files

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