Vitas-M small molecule compound

2-(2-bromo-4-ethylphenoxy)-N-(4H-1,2,4-triazol-3-yl)acetamide

Catalog ID
STK225457
SMILES CCc1ccc(c(c1)Br)OCC(=O)Nc1nnc[nH]1

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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 C12H13BrN4O2 MW 325.16 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H13BrN4O2/c1-2-8-3-4-10(9(13)5-8)19-6-11(18)16-12-14-7-15-17-12/h3-5,7H,2,6H2,1H3,(H2,14,15,16,17,18)
InChIKey
LAMPPSNGZPUTBL-UHFFFAOYSA-N
Synonyms
879079-50-2
2(2BROMO4ETHYLPHENOXY)N(1H124TRIAZOL5YL)ACETAMIDE
2(2bromo4ethylphenoxy)N(4H124triazol3yl)acetamide
879079502
CCC1=CC(=C(C=C1)OCC(=O)NC2=NC=NN2)Br
CCc1ccc(c(c1)Br)OCC(=O)Nc1nnc(nH)1
InChI=1SC12H13BrN4O2c1283410(9(13)58)19611(18)1612147151712h357H26H21H3(H21415161718)
MFCD07088480
ZINC000004833741
ZINC4833741

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Available files

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