Vitas-M small molecule compound

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

Catalog ID
STK475710
SMILES Cc1scc(c1)C(=O)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/c1-14-6-18(13-24-14)19(23)21-2-4-22(5-3-21)20-10-15-7-16(11-20)9-17(8-15)12-20/h6,13,15-17H,2-5,7-12H2,1H3
InChIKey
YIDMBTLZFUVAIN-UHFFFAOYSA-N
Synonyms

(4(1ADAMANTYL)PIPERAZIN1YL)(5METHYLTHIOPHEN3YL)METHANONE
(5methylthiophen3yl)(4(tricyclo(3311~37~)dec1yl)piperazin1yl)methanone
4ADAMANTANYLPIPERAZINYL5METHYL(3THIENYL)KETONE
CC1=CC(=CS1)C(=O)N2CCN(CC2)C34CC5CC(C3)CC(C5)C4
InChI=1SC20H28N2OSc114618(132414)19(23)212422(5321)201015716(1120)917(815)1220h6131517H25712H21H3
ZINC000006730888
ZINC6730888

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Available files

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