Vitas-M small molecule compound

(4-benzylpiperidin-1-yl)(4,4-dioxido-3-phenyl-5,6-dihydro-1,4-oxathiin-2-yl)methanone

Catalog ID
STK656527
SMILES O=C(C1=C(c2ccccc2)S(=O)(=O)CCO1)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 C23H25NO4S MW 411.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H25NO4S/c25-23(24-13-11-19(12-14-24)17-18-7-3-1-4-8-18)21-22(20-9-5-2-6-10-20)29(26,27)16-15-28-21/h1-10,19H,11-17H2
InChIKey
KXKKQNBHDHWFNC-UHFFFAOYSA-N
Synonyms
1144449-88-6
(4benzylpiperidin1yl)(44dioxido3phenyl56dihydro14oxathiin2yl)methanone
(4benzylpiperidin1yl)(44dioxo5phenyl23dihydro14oxathiin6yl)methanone
1144449886
C1CN(CCC1CC2=CC=CC=C2)C(=O)C3=C(S(=O)(=O)CCO3)C4=CC=CC=C4
InChI=1SC23H25NO4Sc2523(24131119(121424)17187314818)2122(2095261020)29(2627)16152821h11019H1117H2
MFCD12213827
ZINC000032092031
ZINC32092031

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Available files

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