Vitas-M small molecule compound

N-(3-methyl-1,1-dioxidotetrahydrothiophen-3-yl)azepane-1-carbothioamide

Catalog ID
STL338067
SMILES S=C(N1CCCCCC1)NC1(C)CCS(=O)(=O)C1

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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 C12H22N2O2S2 MW 290.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H22N2O2S2/c1-12(6-9-18(15,16)10-12)13-11(17)14-7-4-2-3-5-8-14/h2-10H2,1H3,(H,13,17)
InChIKey
UAAVGOTUBIGCLY-UHFFFAOYSA-N
Synonyms
443651-85-2
3((AZAPERHYDROEPINYLTHIOXOMETHYL)AMINO)3METHYLTHIOLANE11DIONE
443651852
CC1(CCS(=O)(=O)C1)NC(=S)N2CCCCCC2
InChI=1SC12H22N2O2S2c112(6918(1516)1012)1311(17)1474235814h210H21H3(H1317)
MFCD03037927
N(3methyl11dioxidotetrahydrothiophen3yl)azepane1carbothioamide
N(3METHYL11DIOXOTHIOLAN3YL)AZEPANE1CARBOTHIOAMIDE
ZINC000004263645
ZINC000004263646

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Available files

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