Vitas-M small molecule compound

N-[1-(benzylamino)-2,2,2-tribromoethyl]-4-methylbenzamide

Catalog ID
STK808471
SMILES Cc1ccc(cc1)C(=O)NC(C(Br)(Br)Br)NCc1ccccc1

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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 C17H17Br3N2O MW 505.05 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17Br3N2O/c1-12-7-9-14(10-8-12)15(23)22-16(17(18,19)20)21-11-13-5-3-2-4-6-13/h2-10,16,21H,11H2,1H3,(H,22,23)
InChIKey
RQWHDONRTVQVBK-UHFFFAOYSA-N
Synonyms

CC1=CC=C(C=C1)C(=O)NC(C(Br)(Br)Br)NCC2=CC=CC=C2
InChI=1SC17H17Br3N2Oc1127914(10812)15(23)2216(17(1819)20)2111135324613h2101621H11H21H3(H2223)
MFCD00548913
N(1(benzylamino)222tribromoethyl)4methylbenzamide
ZINC000015229477
ZINC000015229479

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Available files

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