Vitas-M small molecule compound

2-(1-{2-[2-(phenylsulfanyl)ethoxy]ethyl}piperidin-4-yl)-1,3-benzothiazole

Catalog ID
STK627633
SMILES O(CCN1CCC(CC1)c1nc2c(s1)cccc2)CCSc1ccccc1

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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 C22H26N2OS2 MW 398.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H26N2OS2/c1-2-6-19(7-3-1)26-17-16-25-15-14-24-12-10-18(11-13-24)22-23-20-8-4-5-9-21(20)27-22/h1-9,18H,10-17H2
InChIKey
JAJPVHZBJVFUHV-UHFFFAOYSA-N
Synonyms
929966-27-8
2(1(2(2(phenylsulfanyl)ethoxy)ethyl)piperidin4yl)13benzothiazole
2(1(2(2(phenylthio)ethoxy)ethyl)piperidin4yl)benzo(d)thiazole
2(1(2(2phenylsulfanylethoxy)ethyl)piperidin4yl)13benzothiazole
929966278
C1CN(CCC1C2=NC3=CC=CC=C3S2)CCOCCSC4=CC=CC=C4
InChI=1SC22H26N2OS2c12619(731)26171625151424121018(111324)222320845921(20)2722h1918H1017H2
MFCD09849015
ZINC000009050590
ZINC9050590

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Available files

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