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2-[6-amino-5-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-2-phenylpyrimidin-4-yl]oxyethanol
SpectraBase Compound ID 9BngMpxdgU8
InChI InChI=1S/C20H16ClN5O3/c21-14-8-6-13(7-9-14)18-25-20(29-26-18)15-16(22)23-17(12-4-2-1-3-5-12)24-19(15)28-11-10-27/h1-9,27H,10-11H2,(H2,22,23,24)
InChIKey PTGZJRXGEXWNAW-UHFFFAOYSA-N
Mol Weight 409.83 g/mol
Molecular Formula C20H16ClN5O3
Exact Mass 409.094167 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7sdckP0q7UG
Name 3-(4'-Chlorophenyl)-5-[2'-phenyl-4'-(hydroxyethoxy)-6'-aminopyrimidin-5'-yl]-1,2,4-oxadiazole
Alternate Name(s) 2-({6-amino-5-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-2-phenyl-4-pyrimidinyl}oxy)ethanol 2-[[6-amino-5-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-2-phenyl-4-pyrimidinyl]oxy]ethanol 2-[6-amino-5-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-2-phenylpyrimidin-4-yl]oxyethanol 2-[6-azanyl-5-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-2-phenyl-pyrimidin-4-yl]oxyethanol
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Formula C20H16ClN5O3
InChI InChI=1S/C20H16ClN5O3/c21-14-8-6-13(7-9-14)18-25-20(29-26-18)15-16(22)23-17(12-4-2-1-3-5-12)24-19(15)28-11-10-27/h1-9,27H,10-11H2,(H2,22,23,24)
InChIKey PTGZJRXGEXWNAW-UHFFFAOYSA-N
Molecular Weight 409.833 g/mol
SMILES OCCOc1nc(nc(c1-c1nc(-c2ccc(cc2)Cl)no1)N)-c1ccccc1
SPLASH splash10-0j4l-7988400000-41f7981499f2ef21babc
Source of Spectrum Y-33-1947-11
Wiley ID 1373286