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2,3-Dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazole-4-aldehyde(3-(p-bromophenyl)-2,3,4,5-tetrahydro-4-oxothiazole-2-ylidene)hydrazone

View entire compound with spectra: 1 MS (GC)

2,3-Dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazole-4-aldehyde(3-(p-bromophenyl)-2,3,4,5-tetrahydro-4-oxothiazole-2-ylidene)hydrazone
SpectraBase Compound ID GnUH6LVa6Nn
InChI InChI=1S/C21H18BrN5O2S/c1-14-18(20(29)27(25(14)2)17-6-4-3-5-7-17)12-23-24-21-26(19(28)13-30-21)16-10-8-15(22)9-11-16/h3-12H,13H2,1-2H3/b23-12+,24-21+
InChIKey AVOZYMGWFUWNFR-BZCDASSZSA-N
Mol Weight 484.37 g/mol
Molecular Formula C21H18BrN5O2S
Exact Mass 483.036459 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AJV27zIhJZu
Name 2,3-Dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazole-4-aldehyde(3-(p-bromophenyl)-2,3,4,5-tetrahydro-4-oxothiazole-2-ylidene)hydrazone
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Formula C21H18BrN5O2S
InChI InChI=1S/C21H18BrN5O2S/c1-14-18(20(29)27(25(14)2)17-6-4-3-5-7-17)12-23-24-21-26(19(28)13-30-21)16-10-8-15(22)9-11-16/h3-12H,13H2,1-2H3/b23-12+,24-21+
InChIKey AVOZYMGWFUWNFR-BZCDASSZSA-N
Molecular Weight 484.372 g/mol
SMILES C1(C(=C(C)N(N1c1ccccc1)C)\C=N\N=C/1N(C(=O)CS1)c1ccc(cc1)Br)=O
SPLASH splash10-08gr-5060900000-d91dcdfa70ad729037c2
Source of Spectrum QA-37-507-9
Synonyms 1,5-Dimethyl-3-oxo-2-phenyl-2,3-dihydro-1H-pyrazole-4-carbaldehyde[(2E)-3-(4-bromophenyl)-4-oxo-1,3-thiazolidin-2-ylidene]hydrazone
Wiley ID 861084