Vitas-M small molecule compound

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

Catalog ID
STK441512
SMILES N#Cc1c(NC(=O)C(Cl)Cl)sc2c1CCCCC2

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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 C12H12Cl2N2OS MW 303.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12Cl2N2OS/c13-10(14)11(17)16-12-8(6-15)7-4-2-1-3-5-9(7)18-12/h10H,1-5H2,(H,16,17)
InChIKey
XEBHKXDUMWBGEI-UHFFFAOYSA-N
Synonyms

22dichloroN(3cyano5678tetrahydro4Hcyclohepta(b)thiophen2yl)acetamide
C1CCC2=C(CC1)SC(=C2C#N)NC(=O)C(Cl)Cl
InChI=1SC12H12Cl2N2OSc1310(14)11(17)16128(615)7421359(7)1812h10H15H2(H1617)
MFCD01355717
ZINC000005382609
ZINC5382609

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Available files

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