Vitas-M small molecule compound

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

Catalog ID
STK451598
SMILES CCC1CCc2c(C1)sc(c2C#N)NC(=O)C(C(C(F)(F)F)(F)F)(F)F

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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 C15H13F7N2OS MW 402.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13F7N2OS/c1-2-7-3-4-8-9(6-23)11(26-10(8)5-7)24-12(25)13(16,17)14(18,19)15(20,21)22/h7H,2-5H2,1H3,(H,24,25)
InChIKey
SXDCQRXNSQHSMH-UHFFFAOYSA-N
Synonyms

CCC1CCC2=C(C1)SC(=C2C#N)NC(=O)C(C(C(F)(F)F)(F)F)(F)F
InChI=1SC15H13F7N2OSc1273489(623)11(2610(8)57)2412(25)13(1617)14(1819)15(2021)22h7H25H21H3(H2425)
MFCD03073228
N(3cyano6ethyl4567tetrahydro1benzothiophen2yl)2233444heptafluorobutanamide
ZINC000002103571
ZINC000002103572

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Available files

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