Vitas-M small molecule compound

N-(1,3-benzothiazol-2-ylcarbamothioyl)-5-bromo-2-chlorobenzamide

Catalog ID
STK730279
SMILES S=C(NC(=O)c1cc(Br)ccc1Cl)Nc1nc2c(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 C15H9BrClN3OS2 MW 426.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H9BrClN3OS2/c16-8-5-6-10(17)9(7-8)13(21)19-14(22)20-15-18-11-3-1-2-4-12(11)23-15/h1-7H,(H2,18,19,20,21,22)
InChIKey
XNIXYOHBIWYYOX-UHFFFAOYSA-N
Synonyms
641999-50-0
641999500
C1=CC=C2C(=C1)N=C(S2)NC(=S)NC(=O)C3=C(C=CC(=C3)Br)Cl
InChI=1SC15H9BrClN3OS2c1685610(17)9(78)13(21)1914(22)20151811312412(11)2315h17H(H21819202122)
MFCD03679274
N(13benzothiazol2ylcarbamothioyl)5bromo2chlorobenzamide
N(benzo(d)thiazol2ylcarbamothioyl)5bromo2chlorobenzamide
ZINC000009013959
ZINC09013959
ZINC9013959

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Available files

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