Vitas-M small molecule compound

S-(3,5-di-tert-butyl-4-hydroxybenzyl) benzenecarbothioate

Catalog ID
STK526317
SMILES O=C(c1ccccc1)SCc1cc(c(c(c1)C(C)(C)C)O)C(C)(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 C22H28O2S MW 356.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H28O2S/c1-21(2,3)17-12-15(13-18(19(17)23)22(4,5)6)14-25-20(24)16-10-8-7-9-11-16/h7-13,23H,14H2,1-6H3
InChIKey
WBMDLLSZIVMNPX-UHFFFAOYSA-N
Synonyms
371780-39-1
371780391
CC(C)(C)C1=CC(=CC(=C1O)C(C)(C)C)CSC(=O)C2=CC=CC=C2
InChI=1SC22H28O2Sc121(23)171215(1318(19(17)23)22(45)6)142520(24)16108791116h71323H14H216H3
MFCD01556920
S((35DITERTBUTYL4HYDROXYPHENYL)METHYL)BENZENECARBOTHIOATE
S(35ditertbutyl4hydroxybenzyl)benzenecarbothioate
S35ditertbutyl4hydroxybenzylbenzothioate
ZINC000002262098
ZINC02262098
ZINC2262098

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Available files

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