Vitas-M small molecule compound
2-(4-methylphenyl)-4-[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]isoquinolin-1(2H)-one
Catalog ID
STL104256
SMILES COc1cc(cc(c1OC)OC)c1noc(n1)c1cn(c2ccc(cc2)C)c(=O)c2c1cccc2
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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 C27H23N3O5 MW 469.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23N3O5/c1-16-9-11-18(12-10-16)30-15-21(19-7-5-6-8-20(19)27(30)31)26-28-25(29-35-26)17-13-22(32-2)24(34-4)23(14-17)33-3/h5-15H,1-4H3InChIKey
DWQMBUICDWTSOK-UHFFFAOYSA-NSynonyms
1326879-59-71326879597
2(4methylphenyl)4(3(345trimethoxyphenyl)124oxadiazol5yl)isoquinolin1(2H)one
2(4methylphenyl)4(3(345trimethoxyphenyl)124oxadiazol5yl)isoquinolin1one
2(PTOLYL)4(3(345TRIMETHOXYPHENYL)124OXADIAZOL5YL)ISOQUINOLIN1(2H)ONE
CC1=CC=C(C=C1)N2C=C(C3=CC=CC=C3C2=O)C4=NC(=NO4)C5=CC(=C(C(=C5)OC)OC)OC
InChI=1SC27H23N3O5c11691118(121016)301521(19756820(19)27(30)31)262825(293526)171322(322)24(344)23(1417)333h515H14H3
MFCD20735795
ZINC000067245253
ZINC67245253
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