Vitas-M small molecule compound

3,4-dihydroisoquinolin-2(1H)-yl{1-[(2-methylbenzyl)sulfonyl]piperidin-4-yl}methanone

Catalog ID
STL117464
SMILES O=C(N1CCc2c(C1)cccc2)C1CCN(CC1)S(=O)(=O)Cc1ccccc1C

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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 C23H28N2O3S MW 412.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N2O3S/c1-18-6-2-3-9-22(18)17-29(27,28)25-14-11-20(12-15-25)23(26)24-13-10-19-7-4-5-8-21(19)16-24/h2-9,20H,10-17H2,1H3
InChIKey
BEJYEXFIGNQVMM-UHFFFAOYSA-N
Synonyms

34dihydro1Hisoquinolin2yl(1((2methylphenyl)methylsulfonyl)piperidin4yl)methanone
34dihydroisoquinolin2(1H)yl(1((2methylbenzyl)sulfonyl)piperidin4yl)methanone
CC1=CC=CC=C1CS(=O)(=O)N2CCC(CC2)C(=O)N3CCC4=CC=CC=C4C3
InChI=1SC23H28N2O3Sc118623922(18)1729(2728)25141120(121525)23(26)24131019745821(19)1624h2920H1017H21H3
MFCD11844114
ZINC000024611025
ZINC24611025

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Available files

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