Vitas-M small molecule compound

2,2,2-trichloro-N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)acetamide

Catalog ID
STK387291
SMILES N#Cc1c(sc2c1CCCCC2)NC(=O)C(Cl)(Cl)Cl

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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 C12H11Cl3N2OS MW 337.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H11Cl3N2OS/c13-12(14,15)11(18)17-10-8(6-16)7-4-2-1-3-5-9(7)19-10/h1-5H2,(H,17,18)
InChIKey
XMHVOTLWRFQSKV-UHFFFAOYSA-N
Synonyms
355830-06-7
222trichloroN(3cyano5678tetrahydro4Hcyclohepta(b)thiophen2yl)acetamide
355830067
C1CCC2=C(CC1)SC(=C2C#N)NC(=O)C(Cl)(Cl)Cl
InChI=1SC12H11Cl3N2OSc1312(1415)11(18)17108(616)7421359(7)1910h15H2(H1718)
MFCD01349271
ZINC000004155263
ZINC04155263
ZINC4155263

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Available files

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