Vitas-M small molecule compound
4-[3-(3,4-dimethylphenyl)-1,2,4-oxadiazol-5-yl]-2-(4-ethoxyphenyl)isoquinolin-1(2H)-one
Catalog ID
STL104240
SMILES CCOc1ccc(cc1)n1cc(c2onc(n2)c2ccc(c(c2)C)C)c2c(c1=O)cccc2
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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 C27H23N3O3 MW 437.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23N3O3/c1-4-32-21-13-11-20(12-14-21)30-16-24(22-7-5-6-8-23(22)27(30)31)26-28-25(29-33-26)19-10-9-17(2)18(3)15-19/h5-16H,4H2,1-3H3InChIKey
QWTWAOTUQJTTOG-UHFFFAOYSA-NSynonyms
1326900-66-61326900666
4(3(34dimethylphenyl)124oxadiazol5yl)2(4ethoxyphenyl)isoquinolin1(2H)one
4(3(34dimethylphenyl)124oxadiazol5yl)2(4ethoxyphenyl)isoquinolin1one
CCOC1=CC=C(C=C1)N2C=C(C3=CC=CC=C3C2=O)C4=NC(=NO4)C5=CC(=C(C=C5)C)C
InChI=1SC27H23N3O3c143221131120(121421)301624(22756823(22)27(30)31)262825(293326)1910917(2)18(3)1519h516H4H213H3
MFCD20735780
ZINC000067245223
ZINC67245223
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