Vitas-M small molecule compound

2-[(4-chlorobenzyl)sulfanyl]-5-(phenoxymethyl)-1,3,4-oxadiazole

Catalog ID
STK120462
SMILES Clc1ccc(cc1)CSc1nnc(o1)COc1ccccc1

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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 C16H13ClN2O2S MW 332.81 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13ClN2O2S/c17-13-8-6-12(7-9-13)11-22-16-19-18-15(21-16)10-20-14-4-2-1-3-5-14/h1-9H,10-11H2
InChIKey
ZROMCEXTEQYNDW-UHFFFAOYSA-N
Synonyms
444284-64-4
2((4CHLOROBENZYL)SULFANYL)5(PHENOXYMETHYL)134OXADIAZOLE
2((4chlorobenzyl)thio)5(phenoxymethyl)134oxadiazole
2((4CHLOROPHENYL)METHYLSULFANYL)5(PHENOXYMETHYL)134OXADIAZOLE
444284644
C1=CC=C(C=C1)OCC2=NN=C(O2)SCC3=CC=C(C=C3)Cl
InChI=1SC16H13ClN2O2Sc17138612(7913)112216191815(2116)1020144213514h19H1011H2
MFCD04086105
ZINC000000087604
ZINC00087604
ZINC87604

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Available files

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