Vitas-M small molecule compound

1-(4-{[4-(1,1-dioxido-1,2-thiazinan-2-yl)-2,6-dimethylphenyl]sulfonyl}piperazin-1-yl)ethanone

Catalog ID
STK642111
SMILES CC(=O)N1CCN(CC1)S(=O)(=O)c1c(C)cc(cc1C)N1CCCCS1(=O)=O

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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 C18H27N3O5S2 MW 429.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H27N3O5S2/c1-14-12-17(21-6-4-5-11-27(21,23)24)13-15(2)18(14)28(25,26)20-9-7-19(8-10-20)16(3)22/h12-13H,4-11H2,1-3H3
InChIKey
JLEYVDWZKOENAP-UHFFFAOYSA-N
Synonyms
919966-20-4
1(4((4(11dioxido12thiazinan2yl)26dimethylphenyl)sulfonyl)piperazin1yl)ethanone
1(4(4(11dioxothiazinan2yl)26dimethylphenyl)sulfonylpiperazin1yl)ethanone
919966204
CC1=CC(=CC(=C1S(=O)(=O)N2CCN(CC2)C(=O)C)C)N3CCCCS3(=O)=O
InChI=1SC18H27N3O5S2c1141217(216451127(2123)24)1315(2)18(14)28(2526)209719(81020)16(3)22h1213H411H213H3
MFCD10044300
ZINC000012004337
ZINC12004337

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Available files

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