Vitas-M small molecule compound

(5-methylthiophen-2-yl)[4-(tricyclo[3.3.1.1~3,7~]dec-1-yl)piperazin-1-yl]methanone

Catalog ID
STK483322
SMILES O=C(c1ccc(s1)C)N1CCN(CC1)C12CC3CC(C2)CC(C1)C3

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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 C20H28N2OS MW 344.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H28N2OS/c1-14-2-3-18(24-14)19(23)21-4-6-22(7-5-21)20-11-15-8-16(12-20)10-17(9-15)13-20/h2-3,15-17H,4-13H2,1H3
InChIKey
BDKUMEDARDIRMW-UHFFFAOYSA-N
Synonyms

(4(1adamantyl)piperazin1yl)(5methylthiophen2yl)methanone
(5methylthiophen2yl)(4(tricyclo(3311~37~)dec1yl)piperazin1yl)methanone
4ADAMANTANYLPIPERAZINYL5METHYL(2THIENYL)KETONE
CC1=CC=C(S1)C(=O)N2CCN(CC2)C34CC5CC(C3)CC(C5)C4
InChI=1SC20H28N2OSc1142318(2414)19(23)214622(7521)201115816(1220)1017(915)1320h231517H413H21H3
MFCD08115638
ZINC000013324141
ZINC13324141

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Available files

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