Vitas-M small molecule compound
7-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-(4-methoxybenzyl)[1,2,4]triazolo[1,5-a]pyrimidine
Catalog ID
STL423226
SMILES COc1ccc(cc1)Cc1nc2n(n1)c(ccn2)c1ccc2c(c1)OCCCO2
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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 C22H20N4O3 MW 388.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N4O3/c1-27-17-6-3-15(4-7-17)13-21-24-22-23-10-9-18(26(22)25-21)16-5-8-19-20(14-16)29-12-2-11-28-19/h3-10,14H,2,11-13H2,1H3InChIKey
MIQKPWZQVKGBIU-UHFFFAOYSA-NSynonyms
7(34dihydro2H15benzodioxepin7yl)2((4methoxyphenyl)methyl)(124)triazolo(15a)pyrimidine
7(34dihydro2H15benzodioxepin7yl)2(4methoxybenzyl)(124)triazolo(15a)pyrimidine
7(34dihydro2Hbenzo(b)(14)dioxepin7yl)2(4methoxybenzyl)(124)triazolo(15a)pyrimidine
COC1=CC=C(C=C1)CC2=NN3C(=CC=NC3=N2)C4=CC5=C(C=C4)OCCCO5
InChI=1SC22H20N4O3c127176315(4717)132124222310918(26(22)2521)16581920(1416)29122112819h31014H21113H21H3
MFCD27963126
ZINC000096345332
ZINC96345332
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