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1-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine
SpectraBase Compound ID E44BPlAFdiU
InChI InChI=1S/C20H16BrF3N4O2S/c21-15-4-1-13(2-5-15)16-12-31-19(25-16)27-9-7-26(8-10-27)17-6-3-14(20(22,23)24)11-18(17)28(29)30/h1-6,11-12H,7-10H2
InChIKey YUDKYIUVQSAHMV-UHFFFAOYSA-N
Mol Weight 513.33 g/mol
Molecular Formula C20H16BrF3N4O2S
Exact Mass 512.012944 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JOQ8SOuBDXW
Name 1-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-4-[2-nitro-4-(trifluoromethyl)phenyl]piperazine
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Formula C20H16BrF3N4O2S
InChI InChI=1S/C20H16BrF3N4O2S/c21-15-4-1-13(2-5-15)16-12-31-19(25-16)27-9-7-26(8-10-27)17-6-3-14(20(22,23)24)11-18(17)28(29)30/h1-6,11-12H,7-10H2
InChIKey YUDKYIUVQSAHMV-UHFFFAOYSA-N
Molecular Weight 513.333 g/mol
SMILES c1(N(=O)=O)c(N2CCN(c3nc(-c4ccc(cc4)Br)cs3)CC2)ccc(C(F)(F)F)c1
SPLASH splash10-014r-4890000000-bdbe0418be2b1a8463fd
Synonyms 4-(4-bromophenyl)-2-[4-[2-nitro-4-(trifluoromethyl)phenyl]-1-piperazinyl]thiazole 4-(4-bromophenyl)-2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]-1,3-thiazole 4-(4-bromophenyl)-2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazin-1-yl]thiazole 4-(4-bromophenyl)-2-[4-[2-nitro-4-(trifluoromethyl)phenyl]piperazino]thiazole
Wiley ID 1454875