Vitas-M small molecule compound
(2E)-3-(1,3-benzodioxol-5-yl)-1-[3-([1,2,4]triazolo[4,3-a]pyridin-3-yl)piperidin-1-yl]prop-2-en-1-one
Catalog ID
STK647261
SMILES O=C(N1CCCC(C1)c1nnc2n1cccc2)/C=C/c1ccc2c(c1)OCO2
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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 C21H20N4O3 MW 376.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H20N4O3/c26-20(9-7-15-6-8-17-18(12-15)28-14-27-17)24-10-3-4-16(13-24)21-23-22-19-5-1-2-11-25(19)21/h1-2,5-9,11-12,16H,3-4,10,13-14H2/b9-7+InChIKey
RIPQUHVEWWQNQF-VQHVLOKHSA-NSynonyms
1021078-17-0(2E)3(13benzodioxol5yl)1(3((124)triazolo(43a)pyridin3yl)piperidin1yl)prop2en1one
(E)1(3((124)triazolo(43a)pyridin3yl)piperidin1yl)3(benzo(d)(13)dioxol5yl)prop2en1one
(E)3(13benzodioxol5yl)1(3((124)triazolo(43a)pyridin3yl)piperidin1yl)prop2en1one
1021078170
C1CC(CN(C1)C(=O)C=CC2=CC3=C(C=C2)OCO3)C4=NN=C5N4C=CC=C5
InChI=1SC21H20N4O3c2620(9715681718(1215)28142717)24103416(1324)212322195121125(19)21h1259111216H34101314H2b97+
MFCD12201408
O=C(N1CCCC(C1)c1nnc2n1cccc2)C=Cc1ccc2c(c1)OCO2
ZINC000012389726
ZINC000012389727
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