Vitas-M small molecule compound
7-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-[2-(3,4-dimethoxyphenyl)ethyl][1,2,4]triazolo[1,5-a]pyrimidine
Catalog ID
STL424814
SMILES COc1ccc(cc1OC)CCc1nc2n(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 C24H24N4O4 MW 432.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24N4O4/c1-29-19-7-4-16(14-21(19)30-2)5-9-23-26-24-25-11-10-18(28(24)27-23)17-6-8-20-22(15-17)32-13-3-12-31-20/h4,6-8,10-11,14-15H,3,5,9,12-13H2,1-2H3InChIKey
ZOIBEFVIALGGER-UHFFFAOYSA-NSynonyms
7(34dihydro2H15benzodioxepin7yl)2(2(34dimethoxyphenyl)ethyl)(124)triazolo(15a)pyrimidine
7(34dihydro2Hbenzo(b)(14)dioxepin7yl)2(34dimethoxyphenethyl)(124)triazolo(15a)pyrimidine
COC1=C(C=C(C=C1)CCC2=NN3C(=CC=NC3=N2)C4=CC5=C(C=C4)OCCCO5)OC
InChI=1SC24H24N4O4c129197416(1421(19)302)5923262425111018(28(24)2723)17682022(1517)32133123120h46810111415H3591213H212H3
MFCD27963127
ZINC000096345335
ZINC96345335
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