Vitas-M small molecule compound

1-[(2E)-5-(2-bromophenyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3-(4-methoxyphenyl)urea

Catalog ID
STK565472
SMILES COc1ccc(cc1)NC(=O)/N=c/1\[nH]nc(s1)c1ccccc1Br

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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 C16H13BrN4O2S MW 405.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13BrN4O2S/c1-23-11-8-6-10(7-9-11)18-15(22)19-16-21-20-14(24-16)12-4-2-3-5-13(12)17/h2-9H,1H3,(H2,18,19,21,22)
InChIKey
BBLIFRFUZZMXEM-UHFFFAOYSA-N
Synonyms
428478-85-7
COc1ccc(cc1)NC(=O)N=c1(nH)nc(s1)c1ccccc1Br
MFCD03810343
ZINC000002226780

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Available files

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