Vitas-M small molecule compound

N-[2-(2-bromo-5-iodophenyl)-1,3-benzoxazol-5-yl]-3,5-dichloro-2-methoxybenzamide

Catalog ID
STK240704
SMILES COc1c(Cl)cc(cc1C(=O)Nc1ccc2c(c1)nc(o2)c1cc(I)ccc1Br)Cl

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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 C21H12BrCl2IN2O3 MW 618.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H12BrCl2IN2O3/c1-29-19-14(6-10(23)7-16(19)24)20(28)26-12-3-5-18-17(9-12)27-21(30-18)13-8-11(25)2-4-15(13)22/h2-9H,1H3,(H,26,28)
InChIKey
AOHSWXNUYKMWLN-UHFFFAOYSA-N
Synonyms

COC1=C(C=C(C=C1C(=O)NC2=CC3=C(C=C2)OC(=N3)C4=C(C=CC(=C4)I)Br)Cl)Cl
InChI=1SC21H12BrCl2IN2O3c1291914(610(23)716(19)24)20(28)2612351817(912)2721(3018)13811(25)2415(13)22h29H1H3(H2628)
MFCD03907104
N(2(2bromo5iodophenyl)13benzoxazol5yl)35dichloro2methoxybenzamide
ZINC000150348216
ZINC150348216

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Available files

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