Vitas-M small molecule compound

N-[(E)-(4-bromo-3-nitrophenyl)methylidene]-2-(3-methoxyphenyl)-1,3-benzoxazol-5-amine

Catalog ID
STK749397
SMILES COc1cccc(c1)c1nc2c(o1)ccc(c2)/N=C/c1ccc(c(c1)[N+](=O)[O-])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 C21H14BrN3O4 MW 452.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14BrN3O4/c1-28-16-4-2-3-14(10-16)21-24-18-11-15(6-8-20(18)29-21)23-12-13-5-7-17(22)19(9-13)25(26)27/h2-12H,1H3/b23-12+
InChIKey
LLNVOWVFIBEBDD-FSJBWODESA-N
Synonyms

COc1cccc(c1)c1nc2c(o1)ccc(c2)N=Cc1ccc(c(c1)(N+)(=O)(O))Br
MFCD00736104
N((E)(4bromo3nitrophenyl)methylidene)2(3methoxyphenyl)13benzoxazol5amine
ZINC000001444747

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Available files

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