Vitas-M small molecule compound

N-(5-bromo-2-methoxybenzyl)-1H-1,2,4-triazol-3-amine

Catalog ID
STK511562
SMILES COc1ccc(cc1CNc1n[nH]cn1)Br

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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 C10H11BrN4O MW 283.13 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H11BrN4O/c1-16-9-3-2-8(11)4-7(9)5-12-10-13-6-14-15-10/h2-4,6H,5H2,1H3,(H2,12,13,14,15)
InChIKey
CMDXUVKEMAKRRC-UHFFFAOYSA-N
Synonyms

COC1=C(C=C(C=C1)Br)CNC2=NC=NN2
COc1ccc(cc1CNc1n(nH)cn1)Br
COc1ccc(cc1CNc1n(nH)cn1)BrCl
InChI=1SC10H11BrN4Oc1169328(11)47(9)51210136141510h246H5H21H3(H212131415)
MFCD02951388
N((5BROMO2METHOXYPHENYL)METHYL)1H124TRIAZOL5AMINE
N(5bromo2methoxybenzyl)1H124triazol3amine
N(5bromo2methoxybenzyl)1H124triazol3aminehydrochloride
ZINC000005911075
ZINC05911075
ZINC5911075

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Available files

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