Vitas-M small molecule compound

2-(4-bromophenoxy)-N-[4-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)benzyl]acetamide

Catalog ID
STK519429
SMILES O=C(COc1ccc(cc1)Br)NCc1ccc(cc1)c1nn2c(s1)nnc2C

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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 C19H16BrN5O2S MW 458.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H16BrN5O2S/c1-12-22-23-19-25(12)24-18(28-19)14-4-2-13(3-5-14)10-21-17(26)11-27-16-8-6-15(20)7-9-16/h2-9H,10-11H2,1H3,(H,21,26)
InChIKey
BYZMIRISBMWNQU-UHFFFAOYSA-N
Synonyms

2(4bromophenoxy)N((4(3methyl(124)triazolo(34b)(134)thiadiazol6yl)phenyl)methyl)acetamide
2(4bromophenoxy)N(4(3methyl(124)triazolo(34b)(134)thiadiazol6yl)benzyl)acetamide
CC1=NN=C2N1N=C(S2)C3=CC=C(C=C3)CNC(=O)COC4=CC=C(C=C4)Br
InChI=1SC19H16BrN5O2Sc11222231925(12)2418(2819)144213(3514)102117(26)1127168615(20)7916h29H1011H21H3(H2126)
MFCD12130029
ZINC000020427338
ZINC20427338

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Available files

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