Vitas-M small molecule compound

1-[(2Z)-5-[2-(benzylsulfanyl)phenyl]-1,3,4-thiadiazol-2(3H)-ylidene]-3-(3-chlorophenyl)urea

Catalog ID
STK605888
SMILES Clc1cccc(c1)NC(=O)/N=c\1/[nH]nc(s1)c1ccccc1SCc1ccccc1

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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 C22H17ClN4OS2 MW 452.99 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17ClN4OS2/c23-16-9-6-10-17(13-16)24-21(28)25-22-27-26-20(30-22)18-11-4-5-12-19(18)29-14-15-7-2-1-3-8-15/h1-13H,14H2,(H2,24,25,27,28)
InChIKey
HPMDTIWSBYSSCB-UHFFFAOYSA-N
Synonyms
488853-93-6
Clc1cccc(c1)NC(=O)N=c1(nH)nc(s1)c1ccccc1SCc1ccccc1
MFCD09795919
ZINC000009272377

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Available files

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