Vitas-M small molecule compound

N-[5-(1,3-benzothiazol-2-yl)-2-methoxyphenyl]-2-bromobenzamide

Catalog ID
STK519708
SMILES COc1ccc(cc1NC(=O)c1ccccc1Br)c1nc2c(s1)cccc2

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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 C21H15BrN2O2S MW 439.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H15BrN2O2S/c1-26-18-11-10-13(21-24-16-8-4-5-9-19(16)27-21)12-17(18)23-20(25)14-6-2-3-7-15(14)22/h2-12H,1H3,(H,23,25)
InChIKey
URAHYKBOZGOYKC-UHFFFAOYSA-N
Synonyms

COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3S2)NC(=O)C4=CC=CC=C4Br
InChI=1SC21H15BrN2O2Sc12618111013(212416845919(16)2721)1217(18)2320(25)14623715(14)22h212H1H3(H2325)
MFCD05850204
N(5(13benzothiazol2yl)2methoxyphenyl)2bromobenzamide
ZINC000002885201
ZINC02885201
ZINC2885201

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Available files

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