Vitas-M small molecule compound
{4-[3-(1,3-benzodioxol-5-yl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl}(3-methoxyphenyl)methanone
Catalog ID
STL091758
SMILES COc1cccc(c1)C(=O)N1CCC(CC1)c1onc(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 C22H21N3O5 MW 407.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O5/c1-27-17-4-2-3-16(11-17)22(26)25-9-7-14(8-10-25)21-23-20(24-30-21)15-5-6-18-19(12-15)29-13-28-18/h2-6,11-12,14H,7-10,13H2,1H3InChIKey
VRLBQPWQLZBLBR-UHFFFAOYSA-NSynonyms
(4(3(13benzodioxol5yl)124oxadiazol5yl)piperidin1yl)(3methoxyphenyl)methanone
COC1=CC=CC(=C1)C(=O)N2CCC(CC2)C3=NC(=NO3)C4=CC5=C(C=C4)OCO5
InChI=1SC22H21N3O5c1271742316(1117)22(26)259714(81025)212320(243021)15561819(1215)29132818h26111214H71013H21H3
MFCD18786157
ZINC000023320976
ZINC23320976
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