Vitas-M small molecule compound

2-(4-bromo-2-chlorophenoxy)-1-[4-(methylsulfonyl)piperazin-1-yl]ethanone

Catalog ID
STK465485
SMILES Brc1ccc(c(c1)Cl)OCC(=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 C13H16BrClN2O4S MW 411.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H16BrClN2O4S/c1-22(19,20)17-6-4-16(5-7-17)13(18)9-21-12-3-2-10(14)8-11(12)15/h2-3,8H,4-7,9H2,1H3
InChIKey
VQFTXARUUOEZOR-UHFFFAOYSA-N
Synonyms

2(4bromo2chlorophenoxy)1(4(methylsulfonyl)piperazin1yl)ethanone
2(4BROMO2CHLOROPHENOXY)1(4(METHYLSULFONYL)PIPERAZINYL)ETHAN1ONE
2(4BROMO2CHLOROPHENOXY)1(4METHYLSULFONYLPIPERAZIN1YL)ETHANONE
CS(=O)(=O)N1CCN(CC1)C(=O)COC2=C(C=C(C=C2)Br)Cl
InChI=1SC13H16BrClN2O4Sc122(1920)176416(5717)13(18)921123210(14)811(12)15h238H479H21H3
MFCD06624916
ZINC000002872685
ZINC02872685
ZINC2872685

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Available files

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