Vitas-M small molecule compound

2-bromo-N-{[3-(5-ethyl-1,3-benzoxazol-2-yl)phenyl]carbamothioyl}benzamide

Catalog ID
STL355431
SMILES CCc1ccc2c(c1)nc(o2)c1cccc(c1)NC(=S)NC(=O)c1ccccc1Br

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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 C23H18BrN3O2S MW 480.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18BrN3O2S/c1-2-14-10-11-20-19(12-14)26-22(29-20)15-6-5-7-16(13-15)25-23(30)27-21(28)17-8-3-4-9-18(17)24/h3-13H,2H2,1H3,(H2,25,27,28,30)
InChIKey
QQPZFOWEIQDYKA-UHFFFAOYSA-N
Synonyms

2bromoN((3(5ethyl13benzoxazol2yl)phenyl)carbamothioyl)benzamide
2bromoN((3(5ethylbenzo(d)oxazol2yl)phenyl)carbamothioyl)benzamide
CCC1=CC2=C(C=C1)OC(=N2)C3=CC(=CC=C3)NC(=S)NC(=O)C4=CC=CC=C4Br
InChI=1SC23H18BrN3O2Sc121410112019(1214)2622(2920)1565716(1315)2523(30)2721(28)17834918(17)24h313H2H21H3(H225272830)
MFCD02628283
ZINC000009349576
ZINC09349576
ZINC9349576

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Available files

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