Vitas-M small molecule compound

5,7-diethyl-2-(thiophen-2-yl)-1,3-diazatricyclo[3.3.1.1~3,7~]decan-6-one

Catalog ID
STK682108
SMILES CCC12CN3CC(C2=O)(CN(C1)C3c1cccs1)CC

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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 C16H22N2OS MW 290.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H22N2OS/c1-3-15-8-17-10-16(4-2,14(15)19)11-18(9-15)13(17)12-6-5-7-20-12/h5-7,13H,3-4,8-11H2,1-2H3
InChIKey
QAYZGRLGRFRYJO-UHFFFAOYSA-N
Synonyms
633286-30-3
(1R5R)57diethyl2(thiophen2yl)13diazaadamantan6one
57diethyl2(thiophen2yl)13diazatricyclo(3311~37~)decan6one
633286303
CCC12CN3C(C@@)(C2=O)(CN(C1)C3c1cccs1)CC
CCC12CN3CC(C1=O)(CN(C2)C3C4=CC=CS4)CC
InChI=1SC16H22N2OSc13158171016(4214(15)19)1118(915)13(17)126572012h5713H34811H212H3
MFCD03727325
ZINC000019323248
ZINC19323248

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Available files

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