Vitas-M small molecule compound

1-(3,4-dichlorophenyl)-3-[(2Z)-5-{[(3-methylbenzyl)sulfanyl]methyl}-1,3,4-thiadiazol-2(3H)-ylidene]urea

Catalog ID
STK614579
SMILES Cc1cccc(c1)CSCc1n[nH]/c(=N/C(=O)Nc2ccc(c(c2)Cl)Cl)/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 C18H16Cl2N4OS2 MW 439.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H16Cl2N4OS2/c1-11-3-2-4-12(7-11)9-26-10-16-23-24-18(27-16)22-17(25)21-13-5-6-14(19)15(20)8-13/h2-8H,9-10H2,1H3,(H2,21,22,24,25)
InChIKey
JUTCEHCRTVLUBG-UHFFFAOYSA-N
Synonyms
488107-26-2
488107262
Cc1cccc(c1)CSCc1n(nH)c(=NC(=O)Nc2ccc(c(c2)Cl)Cl)s1
MFCD09796605
ZINC000002328583

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Available files

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