Vitas-M small molecule compound
4-[3-(4-ethoxy-3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-2-(3-fluorophenyl)isoquinolin-1(2H)-one
Catalog ID
STL104349
SMILES CCOc1ccc(cc1OC)c1noc(n1)c1cn(c2cccc(c2)F)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 C26H20FN3O4 MW 457.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H20FN3O4/c1-3-33-22-12-11-16(13-23(22)32-2)24-28-25(34-29-24)21-15-30(18-8-6-7-17(27)14-18)26(31)20-10-5-4-9-19(20)21/h4-15H,3H2,1-2H3InChIKey
WSSXVLBFYHOWNJ-UHFFFAOYSA-NSynonyms
1326926-07-11326926071
4(3(4ethoxy3methoxyphenyl)124oxadiazol5yl)2(3fluorophenyl)isoquinolin1(2H)one
4(3(4ethoxy3methoxyphenyl)124oxadiazol5yl)2(3fluorophenyl)isoquinolin1one
CCOC1=C(C=C(C=C1)C2=NOC(=N2)C3=CN(C(=O)C4=CC=CC=C43)C5=CC(=CC=C5)F)OC
InChI=1SC26H20FN3O4c133322121116(1323(22)322)242825(342924)211530(1886717(27)1418)26(31)201054919(20)21h415H3H212H3
MFCD20735884
ZINC000067245431
ZINC67245431
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