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N'-(4-Bromophenyl)-N-(3-phenyl-4-thioxoquiazolin-3-yl)thiourea

View entire compound with spectra: 1 MS (GC)

N'-(4-Bromophenyl)-N-(3-phenyl-4-thioxoquiazolin-3-yl)thiourea
SpectraBase Compound ID BX3ldUa1D8s
InChI InChI=1S/C21H15BrN4S2/c22-15-10-12-16(13-11-15)23-21(28)25-26-19(14-6-2-1-3-7-14)24-18-9-5-4-8-17(18)20(26)27/h1-13H,(H2,23,25,28)
InChIKey OXWBVIYBOYDAQW-UHFFFAOYSA-N
Mol Weight 467.4 g/mol
Molecular Formula C21H15BrN4S2
Exact Mass 465.992152 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Pe08IuOrKi
Name N'-(4-Bromophenyl)-N-(3-phenyl-4-thioxoquiazolin-3-yl)thiourea
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H15BrN4S2
InChI InChI=1S/C21H15BrN4S2/c22-15-10-12-16(13-11-15)23-21(28)25-26-19(14-6-2-1-3-7-14)24-18-9-5-4-8-17(18)20(26)27/h1-13H,(H2,23,25,28)
InChIKey OXWBVIYBOYDAQW-UHFFFAOYSA-N
Molecular Weight 467.403 g/mol
SMILES N(N1C(=Nc2c(C1=S)cccc2)c1ccccc1)C(Nc1ccc(cc1)Br)=S
SPLASH splash10-001i-0120900000-c6d7a2793587c6cc5203
Source of Spectrum SO-0-882-3
Wiley ID 1538252