Vitas-M small molecule compound

methyl {4-[(4-benzylpiperidin-1-yl)sulfonyl]-2-chlorophenoxy}acetate

Catalog ID
STK130558
SMILES COC(=O)COc1ccc(cc1Cl)S(=O)(=O)N1CCC(CC1)Cc1ccccc1

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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 C21H24ClNO5S MW 437.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24ClNO5S/c1-27-21(24)15-28-20-8-7-18(14-19(20)22)29(25,26)23-11-9-17(10-12-23)13-16-5-3-2-4-6-16/h2-8,14,17H,9-13,15H2,1H3
InChIKey
RILBAOUQDZHIAR-UHFFFAOYSA-N
Synonyms

COC(=O)COC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)CC3=CC=CC=C3)Cl
InChI=1SC21H24ClNO5Sc12721(24)1528208718(1419(20)22)29(2526)2311917(101223)13165324616h281417H91315H21H3
METHYL(4((4BENZYLPIPERIDIN1YL)SULFONYL)2CHLOROPHENOXY)ACETATE
METHYL2(4(4BENZYLPIPERIDIN1YL)SULFONYL2CHLOROPHENOXY)ACETATE
MFCD04367391
ZINC000001121892
ZINC01121892
ZINC1121892

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Available files

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