Vitas-M small molecule compound

3-[(4-bromophenoxy)methyl]-6-phenyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazole

Catalog ID
STK500165
SMILES Brc1ccc(cc1)OCc1nnc2n1nc(s2)c1ccccc1

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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 C16H11BrN4OS MW 387.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H11BrN4OS/c17-12-6-8-13(9-7-12)22-10-14-18-19-16-21(14)20-15(23-16)11-4-2-1-3-5-11/h1-9H,10H2
InChIKey
TZADKXRSAWGEEP-UHFFFAOYSA-N
Synonyms

3((4bromophenoxy)methyl)6phenyl(124)triazolo(34b)(134)thiadiazole
C1=CC=C(C=C1)C2=NN3C(=NN=C3S2)COC4=CC=C(C=C4)Br
InChI=1SC16H11BrN4OSc17126813(9712)22101418191621(14)2015(2316)114213511h19H10H2
MFCD09184377
ZINC000010312045
ZINC10312045

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Available files

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