Vitas-M small molecule compound
[3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]methyl (2E)-3-(pyridin-3-yl)prop-2-enoate
Catalog ID
STK900866
SMILES O=C(/C=C/c1cccnc1)OCc1onc(n1)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 C18H13N3O5 MW 351.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H13N3O5/c22-17(6-3-12-2-1-7-19-9-12)23-10-16-20-18(21-26-16)13-4-5-14-15(8-13)25-11-24-14/h1-9H,10-11H2/b6-3+InChIKey
BOGUOJXGSBOXOZ-ZZXKWVIFSA-NSynonyms
(3(13benzodioxol5yl)124oxadiazol5yl)methyl(2E)3(pyridin3yl)prop2enoate
(3(13benzodioxol5yl)124oxadiazol5yl)methyl(E)3pyridin3ylprop2enoate
C1OC2=C(O1)C=C(C=C2)C3=NOC(=N3)COC(=O)C=CC4=CN=CC=C4
InChI=1SC18H13N3O5c2217(631221719912)2310162018(212616)13451415(813)25112414h19H1011H2b63+
MFCD18173682
O=C(C=Cc1cccnc1)OCc1onc(n1)c1ccc2c(c1)OCO2
ZINC000044836855
ZINC44836855
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