Vitas-M small molecule compound
diethyl (hydroxymethyl){4-[2-(pyridin-3-yl)piperidin-1-yl]but-2-yn-1-yl}propanedioate
Catalog ID
STK688199
SMILES CCOC(=O)C(C(=O)OCC)(CC#CCN1CCCCC1c1cccnc1)CO
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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 C22H30N2O5 MW 402.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H30N2O5/c1-3-28-20(26)22(17-25,21(27)29-4-2)12-6-8-15-24-14-7-5-11-19(24)18-10-9-13-23-16-18/h9-10,13,16,19,25H,3-5,7,11-12,14-15,17H2,1-2H3InChIKey
YRLZARYOUVERIR-UHFFFAOYSA-NSynonyms
CCOC(=O)C(CC#CCN1CCCCC1C2=CN=CC=C2)(CO)C(=O)OCC
diethyl(hydroxymethyl)(4(2(pyridin3yl)piperidin1yl)but2yn1yl)propanedioate
DIETHYL2(HYDROXYMETHYL)2(4(2PYRIDIN3YLPIPERIDIN1YL)BUT2YNYL)PROPANEDIOATE
InChI=1SC22H30N2O5c132820(26)22(172521(27)2942)1268152414751119(24)1810913231618h91013161925H3571112141517H212H3
MFCD07657064
ZINC000055243886
ZINC000055243890
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