Vitas-M small molecule compound
2-(3,4-dimethylphenyl)-4-[3-(3,4-dimethylphenyl)-1,2,4-oxadiazol-5-yl]isoquinolin-1(2H)-one
Catalog ID
STL104282
SMILES Cc1ccc(cc1C)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 C27H23N3O2 MW 421.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23N3O2/c1-16-9-11-20(13-18(16)3)25-28-26(32-29-25)24-15-30(21-12-10-17(2)19(4)14-21)27(31)23-8-6-5-7-22(23)24/h5-15H,1-4H3InChIKey
ROTMUHWIHVYUBV-UHFFFAOYSA-NSynonyms
1326900-95-11326900951
2(34dimethylphenyl)4(3(34dimethylphenyl)124oxadiazol5yl)isoquinolin1(2H)one
2(34dimethylphenyl)4(3(34dimethylphenyl)124oxadiazol5yl)isoquinolin1one
CC1=C(C=C(C=C1)C2=NOC(=N2)C3=CN(C(=O)C4=CC=CC=C43)C5=CC(=C(C=C5)C)C)C
InChI=1SC27H23N3O2c11691120(1318(16)3)252826(322925)241530(21121017(2)19(4)1421)27(31)23865722(23)24h515H14H3
MFCD20735821
ZINC000067245305
ZINC67245305
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