Vitas-M small molecule compound

N-{[3-(3,4-dimethylphenyl)tricyclo[3.3.1.1~3,7~]dec-1-yl]methyl}-2,6-dimethoxybenzamide

Catalog ID
STK665244
SMILES COc1cccc(c1C(=O)NCC12CC3CC(C1)CC(C2)(C3)c1ccc(c(c1)C)C)OC

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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 C28H35NO3 MW 433.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H35NO3/c1-18-8-9-22(10-19(18)2)28-14-20-11-21(15-28)13-27(12-20,16-28)17-29-26(30)25-23(31-3)6-5-7-24(25)32-4/h5-10,20-21H,11-17H2,1-4H3,(H,29,30)
InChIKey
KNYXGOBZQAFZSY-UHFFFAOYSA-N
Synonyms

CC1=C(C=C(C=C1)C23CC4CC(C2)CC(C4)(C3)CNC(=O)C5=C(C=CC=C5OC)OC)C
InChI=1SC28H35NO3c1188922(1019(18)2)2814201121(1528)1327(12201628)172926(30)2523(313)65724(25)324h5102021H1117H214H3(H2930)
MFCD08142673
N((3(34dimethylphenyl)1adamantyl)methyl)26dimethoxybenzamide
N((3(34dimethylphenyl)tricyclo(3311~37~)dec1yl)methyl)26dimethoxybenzamide
ZINC000018118983

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Available files

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