Explore 4548 | PiHKAL · info

Exploring 4548. To explore a different substance…

IUPAC name

2-Methyl-5-(octahydroisoquinoline-2(1H)-carbonyl)-N-(propan-2-yl)benzene-1-sulfonamide

ID 4548 · Formula C₂₀H₃₀N₂O₃S · Molecular weight 378.529

Tags Cannabinoid

InChI InChI=1S/C20H30N2O3S/c1-14(2)21-26(24,25)19-12-17(9-8-15(19)3)20(23)22-11-10-16-6-4-5-7-18(16)13-22/h8-9,12,14,16,18,21H,4-7,10-11,13H2,1-3H3

InChI Key KXZFUKFUOLAZPJ-UHFFFAOYSA-N This stereoisomer Any stereoisomer

SMILES CC(NS(=O)(=O)c1cc(ccc1C)C(=O)N1CCC2C(C1)CCCC2)C

ChemSpider 23312832
PubChem 25003966

Ermann, M; Riether, D; Walker, ER; Mushi, IF; Jenkins, JE; Noya-Marino, B; Brewer, ML; Taylor, MG; Amouzegh, P; East, SP; Dymock, BW; Gemkow, MJ; Kahrs, AF; Ebneth, A; Löbbe, S; O’Shea, K; Shih, D; Thomson, D. Arylsulfonamide CB2 receptor agonists: SAR and optimization of CB2 selectivity Bioorg. Med. Chem. Lett., 1 Mar 2008, 18 (5), 1725–1729. 134 kB. https://doi.org/10.1016/j.bmcl.2008.01.042 #27

Brandt, SD; Kavanagh, PV; Westphal, F; Dreiseitel, W; Dowling, G; Bowden, MJ; Williamson, JPB. Synthetic cannabinoid receptor agonists: Analytical profiles and development of QMPSB, QMMSB, QMPCB, 2F-QMPSB, QMiPSB, and SGT-233 Drug Test. Anal., 16 Aug 2020, 13 (1), 175-196. 2.6 MB. https://doi.org/10.1002/dta.2913 #11 GC,MS,NMR

7 Dec 2019 · · Isomer Design