Vitas-M small molecule compound
(3S)-2-{2-[(2-chlorobenzyl)oxy]phenyl}-3-(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbonyl)cyclopropane-1,1-dicarbonitrile
Catalog ID
STK548078
SMILES N#CC1(C#N)[C@H](C1c1ccccc1OCc1ccccc1Cl)C(=O)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 C29H27ClN2O2 MW 471.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H27ClN2O2/c30-23-7-3-1-5-21(23)15-34-24-8-4-2-6-22(24)25-26(29(25,16-31)17-32)27(33)28-12-18-9-19(13-28)11-20(10-18)14-28/h1-8,18-20,25-26H,9-15H2/t18?,19?,20?,25?,26-,28?/m1/s1InChIKey
RVKXCMFBIQAVFU-AYHVKWNWSA-NSynonyms
494793-00-9(2S)2((3S5S7S)adamantane1carbonyl)3(2((2chlorobenzyl)oxy)phenyl)cyclopropane11dicarbonitrile
(2S)2(adamantane1carbonyl)3(2((2chlorophenyl)methoxy)phenyl)cyclopropane11dicarbonitrile
(3S)2(2((2chlorobenzyl)oxy)phenyl)3(tricyclo(3311~37~)dec1ylcarbonyl)cyclopropane11dicarbonitrile
2(1ADAMANTYLCARBONYL)3(2((2CHLOROBENZYL)OXY)PHENYL)11CYCLOPROPANEDICARBONITRILE
494793009
C1C2CC3CC1CC(C2)(C3)C(=O)C4C(C4(C#N)C#N)C5=CC=CC=C5OCC6=CC=CC=C6Cl
InChI=1SC29H27ClN2O2c3023731521(23)153424842622(24)2526(29(251631)1732)27(33)281218919(1328)1120(1018)1428h1818202526H915H2t18?19?20?25?2628?m1s1
MFCD18242398
N#CC1(C#N)(C@H)(C1c1ccccc1OCc1ccccc1Cl)C(=O)C12CC3CC(C2)CC(C1)C3
ZINC000008747779
ZINC000008747780
Check stock
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Check stock on Vitas-MAvailable files
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