Vitas-M small molecule compound

2-chloro-N-(3-cyano-6-ethyl-4,5,6,7-tetrahydro-1-benzothiophen-2-yl)acetamide

Catalog ID
STK502481
SMILES CCC1CCc2c(C1)sc(c2C#N)NC(=O)CCl

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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 C13H15ClN2OS MW 282.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H15ClN2OS/c1-2-8-3-4-9-10(7-15)13(16-12(17)6-14)18-11(9)5-8/h8H,2-6H2,1H3,(H,16,17)
InChIKey
MODXYKLCFWAIIU-UHFFFAOYSA-N
Synonyms
551899-66-2
2chloroN(3cyano6ethyl4567tetrahydro1benzothiophen2yl)acetamide
551899662
CCC1CCC2=C(C1)SC(=C2C#N)NC(=O)CCl
InChI=1SC13H15ClN2OSc12834910(715)13(1612(17)614)1811(9)58h8H26H21H3(H1617)
MFCD01354872
ZINC000005476541
ZINC000005476894

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Available files

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