Vitas-M small molecule compound

1-{[(4-benzylpiperidin-1-yl)sulfonyl]methyl}-7,7-dimethylbicyclo[2.2.1]heptan-2-one

Catalog ID
STK523871
SMILES O=C1CC2C(C1(CC2)CS(=O)(=O)N1CCC(CC1)Cc1ccccc1)(C)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 C22H31NO3S MW 389.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H31NO3S/c1-21(2)19-8-11-22(21,20(24)15-19)16-27(25,26)23-12-9-18(10-13-23)14-17-6-4-3-5-7-17/h3-7,18-19H,8-16H2,1-2H3
InChIKey
CMJBXHCEWSTHJG-UHFFFAOYSA-N
Synonyms
722473-63-4
1(((4benzylpiperidin1yl)sulfonyl)methyl)77dimethylbicyclo(221)heptan2one
4((4BENZYLPIPERIDIN1YL)SULFONYLMETHYL)77DIMETHYLBICYCLO(221)HEPTAN3ONE
722473634
CC1(C2CCC1(C(=O)C2)CS(=O)(=O)N3CCC(CC3)CC4=CC=CC=C4)C
InChI=1SC22H31NO3Sc121(2)1981122(2120(24)1519)1627(2526)2312918(101323)14176435717h371819H816H212H3
MFCD03957022
ZINC000100220665

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Available files

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