Vitas-M small molecule compound

1,3,5-trimethyl-2-{[2-(propan-2-yl)phenyl]sulfonyl}benzene

Catalog ID
STK331130
SMILES Cc1cc(C)c(c(c1)C)S(=O)(=O)c1ccccc1C(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 C18H22O2S MW 302.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22O2S/c1-12(2)16-8-6-7-9-17(16)21(19,20)18-14(4)10-13(3)11-15(18)5/h6-12H,1-5H3
InChIKey
VKNASMSYDCERRE-UHFFFAOYSA-N
Synonyms

135trimethyl2((2(propan2yl)phenyl)sulfonyl)benzene
135trimethyl2(2propan2ylphenyl)sulfonylbenzene
CC1=CC(=C(C(=C1)C)S(=O)(=O)C2=CC=CC=C2C(C)C)C
InChI=1SC18H22O2Sc112(2)16867917(16)21(1920)1814(4)1013(3)1115(18)5h612H15H3
MFCD00413661
ZINC000003153776
ZINC03153776
ZINC3153776

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Available files

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