Vitas-M small molecule compound

4-[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-(3,4-dimethylphenyl)isoquinolin-1(2H)-one

Catalog ID
STL104277
SMILES COc1cc(ccc1OC)c1noc(n1)c1cn(c2ccc(c(c2)C)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 C27H23N3O4 MW 453.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23N3O4/c1-16-9-11-19(13-17(16)2)30-15-22(20-7-5-6-8-21(20)27(30)31)26-28-25(29-34-26)18-10-12-23(32-3)24(14-18)33-4/h5-15H,1-4H3
InChIKey
FMWBNVLIKGNSDR-UHFFFAOYSA-N
Synonyms
1326859-76-0
1326859760
4(3(34dimethoxyphenyl)124oxadiazol5yl)2(34dimethylphenyl)isoquinolin1(2H)one
4(3(34dimethoxyphenyl)124oxadiazol5yl)2(34dimethylphenyl)isoquinolin1one
CC1=C(C=C(C=C1)N2C=C(C3=CC=CC=C3C2=O)C4=NC(=NO4)C5=CC(=C(C=C5)OC)OC)C
InChI=1SC27H23N3O4c11691119(1317(16)2)301522(20756821(20)27(30)31)262825(293426)18101223(323)24(1418)334h515H14H3
MFCD20735816
ZINC000067245295
ZINC67245295

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Available files

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