Vitas-M small molecule compound

1-(4-benzylpiperazin-1-yl)-4-[4-(methylsulfonyl)piperazin-1-yl]butane-1,4-dione

Catalog ID
STK633649
SMILES O=C(N1CCN(CC1)Cc1ccccc1)CCC(=O)N1CCN(CC1)S(=O)(=O)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 C20H30N4O4S MW 422.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H30N4O4S/c1-29(27,28)24-15-13-23(14-16-24)20(26)8-7-19(25)22-11-9-21(10-12-22)17-18-5-3-2-4-6-18/h2-6H,7-17H2,1H3
InChIKey
KUFFDSHKGHHYTL-UHFFFAOYSA-N
Synonyms
1081144-55-9
1(4benzylpiperazin1yl)4(4(methylsulfonyl)piperazin1yl)butane14dione
1(4benzylpiperazin1yl)4(4methylsulfonylpiperazin1yl)butane14dione
1081144559
CS(=O)(=O)N1CCN(CC1)C(=O)CCC(=O)N2CCN(CC2)CC3=CC=CC=C3
InChI=1SC20H30N4O4Sc129(2728)24151323(141624)20(26)8719(25)2211921(101222)17185324618h26H717H21H3
MFCD12205315
ZINC000020715021
ZINC20715021

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Available files

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