Vitas-M small molecule compound
2-(2-bromo-4,6-dimethylphenoxy)-N-[2-(3-methyl[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]acetamide
Catalog ID
STK389898
SMILES O=C(Nc1ccccc1c1sc2n(n1)c(nn2)C)COc1c(C)cc(cc1Br)C
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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 C20H18BrN5O2S MW 472.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18BrN5O2S/c1-11-8-12(2)18(15(21)9-11)28-10-17(27)22-16-7-5-4-6-14(16)19-25-26-13(3)23-24-20(26)29-19/h4-9H,10H2,1-3H3,(H,22,27)InChIKey
NUIIDHPRSSUHIB-UHFFFAOYSA-NSynonyms
2(2bromo46dimethylphenoxy)N(2(3methyl(124)triazolo(34b)(134)thiadiazol6yl)phenyl)acetamide
CC1=CC(=C(C(=C1)Br)OCC(=O)NC2=CC=CC=C2C3=NN4C(=NN=C4S3)C)C
InChI=1SC20H18BrN5O2Sc111812(2)18(15(21)911)281017(27)2216754614(16)19252613(3)232420(26)2919h49H10H213H3(H2227)
MFCD06758062
ZINC000016267150
ZINC16267150
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