Vitas-M small molecule compound

N-(5-chloro-6-methoxy-1,3-benzothiazol-2-yl)-4-(methylsulfanyl)-2-(1H-pyrrol-1-yl)butanamide

Catalog ID
STL577951
SMILES CSCCC(C(=O)Nc1sc2c(n1)cc(c(c2)OC)Cl)n1cccc1

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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 C17H18ClN3O2S2 MW 395.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18ClN3O2S2/c1-23-14-10-15-12(9-11(14)18)19-17(25-15)20-16(22)13(5-8-24-2)21-6-3-4-7-21/h3-4,6-7,9-10,13H,5,8H2,1-2H3,(H,19,20,22)
InChIKey
MKXDEZOBSUWABM-UHFFFAOYSA-N
Synonyms

(R)N(5chloro6methoxybenzo(d)thiazol2yl)4(methylthio)2(1Hpyrrol1yl)butanamide
CSCC(C@H)(C(=O)Nc1sc2c(n1)cc(c(c2)OC)Cl)n1cccc1
InChI=1SC17H18ClN3O2S2c12314101512(911(14)18)1917(2515)2016(22)13(58242)21634721h346791013H58H212H3(H192022)
MFCD32008638
N(5chloro6methoxy13benzothiazol2yl)4(methylsulfanyl)2(1Hpyrrol1yl)butanamide

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Available files

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