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4-[4-(p-Bromophenyl)thiazol-2-yl]-5-methyl-2-phenyl-2,4-dihydro-3H-1,2,4-triazol-3-one
SpectraBase Compound ID LFUkwGEbI2o
InChI InChI=1S/C18H13BrN4OS/c1-12-21-23(15-5-3-2-4-6-15)18(24)22(12)17-20-16(11-25-17)13-7-9-14(19)10-8-13/h2-11H,1H3
InChIKey SACDCXJAJRFHAS-UHFFFAOYSA-N
Mol Weight 413.29 g/mol
Molecular Formula C18H13BrN4OS
Exact Mass 411.999345 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5L8A54LHybX
Name 4-[4-(p-Bromophenyl)thiazol-2-yl]-5-methyl-2-phenyl-2,4-dihydro-3H-1,2,4-triazol-3-one
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Formula C18H13BrN4OS
InChI InChI=1S/C18H13BrN4OS/c1-12-21-23(15-5-3-2-4-6-15)18(24)22(12)17-20-16(11-25-17)13-7-9-14(19)10-8-13/h2-11H,1H3
InChIKey SACDCXJAJRFHAS-UHFFFAOYSA-N
Molecular Weight 413.293 g/mol
SMILES C1(N(C(=NN1c1ccccc1)C)c1nc(-c2ccc(cc2)Br)cs1)=O
SPLASH splash10-0a4i-3960300000-3f5a5b0c21ecd7b401be
Source of Spectrum HC-47-883-1l
Synonyms 4-(4-(4-bromophenyl)thiazol-2-yl)-3-methyl-1-phenyl-1H-1,2,4-triazol-5(4H)-one 4-[4-(4-bromophenyl)-2-thiazolyl]-5-methyl-2-phenyl-1,2,4-triazol-3-one 4-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-5-methyl-2-phenyl-1,2,4-triazol-3-one
Wiley ID 1734152