Vitas-M small molecule compound

N-[(2Z)-5-[(3-acetyl-2,4,6-trimethylbenzyl)sulfanyl]-1,3,4-thiadiazol-2(3H)-ylidene]-2-methoxybenzamide

Catalog ID
STK853245
SMILES COc1ccccc1C(=O)/N=c\1/[nH]nc(s1)SCc1c(C)cc(c(c1C)C(=O)C)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 C22H23N3O3S2 MW 441.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H23N3O3S2/c1-12-10-13(2)19(15(4)26)14(3)17(12)11-29-22-25-24-21(30-22)23-20(27)16-8-6-7-9-18(16)28-5/h6-10H,11H2,1-5H3,(H,23,24,27)
InChIKey
ODXDBJCPLKYSMO-UHFFFAOYSA-N
Synonyms
690692-44-5
690692445
COc1ccccc1C(=O)N=c1(nH)nc(s1)SCc1c(C)cc(c(c1C)C(=O)C)C
MFCD07211406
ZINC000009320577

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Available files

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