Vitas-M small molecule compound

{4-[(pentamethylphenyl)sulfonyl]piperazin-1-yl}(tetrahydrofuran-2-yl)methanone

Catalog ID
STK469813
SMILES O=C(N1CCN(CC1)S(=O)(=O)c1c(C)c(C)c(c(c1C)C)C)C1CCCO1

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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 C20H30N2O4S MW 394.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H30N2O4S/c1-13-14(2)16(4)19(17(5)15(13)3)27(24,25)22-10-8-21(9-11-22)20(23)18-7-6-12-26-18/h18H,6-12H2,1-5H3
InChIKey
WYNRYKHIKOLTMK-UHFFFAOYSA-N
Synonyms
888192-46-9
(4((pentamethylphenyl)sulfonyl)piperazin1yl)(tetrahydrofuran2yl)methanone
888192469
CC1=C(C(=C(C(=C1C)C)S(=O)(=O)N2CCN(CC2)C(=O)C3CCCO3)C)C
InChI=1SC20H30N2O4Sc11314(2)16(4)19(17(5)15(13)3)27(2425)2210821(91122)20(23)1876122618h18H612H215H3
MFCD06030152
oxolan2yl(4(23456pentamethylphenyl)sulfonylpiperazin1yl)methanone
ZINC000008090260
ZINC000008090261

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Available files

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