Vitas-M small molecule compound

N-[(2E)-5-(3,4-dimethoxyphenyl)-1,3,4-thiadiazol-2(3H)-ylidene]-3,4,5-trimethoxybenzamide

Catalog ID
STL049536
SMILES COc1ccc(cc1OC)c1n[nH]/c(=N\C(=O)c2cc(OC)c(c(c2)OC)OC)/s1

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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 C20H21N3O6S MW 431.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H21N3O6S/c1-25-13-7-6-11(8-14(13)26-2)19-22-23-20(30-19)21-18(24)12-9-15(27-3)17(29-5)16(10-12)28-4/h6-10H,1-5H3,(H,21,23,24)
InChIKey
WFFGKGXFJPFDCL-UHFFFAOYSA-N
Synonyms
461015-22-5
461015225
COc1ccc(cc1OC)c1n(nH)c(=NC(=O)c2cc(OC)c(c(c2)OC)OC)s1
MFCD05727637
ZINC000017207873

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Available files

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