Vitas-M small molecule compound
5-(azepan-1-yl)-2-[(1,3-benzodioxol-5-yloxy)methyl]-1,3-oxazole-4-carbonitrile
Catalog ID
STK657729
SMILES N#Cc1nc(oc1N1CCCCCC1)COc1ccc2c(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 C18H19N3O4 MW 341.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H19N3O4/c19-10-14-18(21-7-3-1-2-4-8-21)25-17(20-14)11-22-13-5-6-15-16(9-13)24-12-23-15/h5-6,9H,1-4,7-8,11-12H2InChIKey
VYMOMAKLUAEYHD-UHFFFAOYSA-NSynonyms
1144471-49-71144471497
5(azepan1yl)2((13benzodioxol5yloxy)methyl)13oxazole4carbonitrile
5(azepan1yl)2((benzo(d)(13)dioxol5yloxy)methyl)oxazole4carbonitrile
5(azepan1yl)2(13benzodioxol5yloxymethyl)13oxazole4carbonitrile
C1CCCN(CC1)C2=C(N=C(O2)COC3=CC4=C(C=C3)OCO4)C#N
InChI=1SC18H19N3O4c19101418(2173124821)2517(2014)112213561516(913)24122315h569H14781112H2
MFCD12218347
ZINC000032105627
ZINC32105627
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