Vitas-M small molecule compound

1,3-benzothiazol-2-ylmethyl tricyclo[3.3.1.1~3,7~]dec-1-ylacetate

Catalog ID
STK664579
SMILES O=C(CC12CC3CC(C2)CC(C1)C3)OCc1nc2c(s1)cccc2

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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 C20H23NO2S MW 341.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23NO2S/c22-19(23-12-18-21-16-3-1-2-4-17(16)24-18)11-20-8-13-5-14(9-20)7-15(6-13)10-20/h1-4,13-15H,5-12H2
InChIKey
SGYJWQMKLAMHHE-UHFFFAOYSA-N
Synonyms
454428-08-1
(ADAMANTAN1YL)ACETICACID(BENZOTHIAZOL2YL)METHYLESTER
13BENZOTHIAZOL2YLMETHYL2(1ADAMANTYL)ACETATE
13benzothiazol2ylmethyltricyclo(3311~37~)dec1ylacetate
454428081
BENZOTHIAZOL2YLMETHYL2ADAMANTANYLACETATE
C1C2CC3CC1CC(C2)(C3)CC(=O)OCC4=NC5=CC=CC=C5S4
InChI=1SC20H23NO2Sc2219(2312182116312417(16)2418)1120813514(920)715(613)1020h141315H512H2
MFCD05857343
ZINC000004625761
ZINC04625761
ZINC4625761

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Available files

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