Vitas-M small molecule compound

1-(4-bromophenyl)-5-[(2,4,6-trimethylphenoxy)methyl]-1H-tetrazole

Catalog ID
STK617043
SMILES Cc1cc(C)c(c(c1)C)OCc1nnnn1c1ccc(cc1)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 C17H17BrN4O MW 373.25 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H17BrN4O/c1-11-8-12(2)17(13(3)9-11)23-10-16-19-20-21-22(16)15-6-4-14(18)5-7-15/h4-9H,10H2,1-3H3
InChIKey
IMFLMEMLLONNSY-UHFFFAOYSA-N
Synonyms
898653-30-0
1(4bromophenyl)5((246trimethylphenoxy)methyl)1Htetrazole
1(4BROMOPHENYL)5((246TRIMETHYLPHENOXY)METHYL)TETRAZOLE
1(4bromophenyl)5((mesityloxy)methyl)1Htetrazole
898653300
CC1=CC(=C(C(=C1)C)OCC2=NN=NN2C3=CC=C(C=C3)Br)C
InChI=1SC17H17BrN4Oc111812(2)17(13(3)911)23101619202122(16)156414(18)5715h49H10H213H3
MFCD08291370
ZINC000006759970
ZINC06759970
ZINC6759970

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Available files

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