Vitas-M small molecule compound
ethyl 1,1-dicyano-2-(tricyclo[3.3.1.1~3,7~]dec-1-ylcarbonyl)-6-azaspiro[2.5]octane-6-carboxylate
Catalog ID
STK847757
SMILES CCOC(=O)N1CCC2(CC1)C(C2(C#N)C#N)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 C23H29N3O3 MW 395.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29N3O3/c1-2-29-20(28)26-5-3-22(4-6-26)18(23(22,13-24)14-25)19(27)21-10-15-7-16(11-21)9-17(8-15)12-21/h15-18H,2-12H2,1H3InChIKey
ZURROFZOBKEEGP-UHFFFAOYSA-NSynonyms
625375-66-8625375668
CCOC(=O)N1CCC2(CC1)C(C2(C#N)C#N)C(=O)C34CC5CC(C3)CC(C5)C4
ETHYL1(ADAMANTANE1CARBONYL)22DICYANO6AZASPIRO(25)OCTANE6CARBOXYLATE
ethyl11dicyano2(tricyclo(3311~37~)dec1ylcarbonyl)6azaspiro(25)octane6carboxylate
ethyl2((1R3s)adamantane1carbonyl)11dicyano6azaspiro(25)octane6carboxylate
ETHYL2(ADAMANTANYLCARBONYL)11DICYANO6AZASPIRO(25)OCTANE6CARBOXYLATE
InChI=1SC23H29N3O3c122920(28)265322(4626)18(23(221324)1425)19(27)211015716(1121)917(815)1221h1518H212H21H3
MFCD03730744
ZINC000004283076
ZINC000004283077
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