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

View entire compound with spectra: 1 MS (GC)

N'-(4-Methylphenyl)-N-(3-phenyl-4-thioxoquiazolin-3-yl)thiourea
SpectraBase Compound ID IkJ3iHc1Ops
InChI InChI=1S/C22H18N4S2/c1-15-11-13-17(14-12-15)23-22(28)25-26-20(16-7-3-2-4-8-16)24-19-10-6-5-9-18(19)21(26)27/h2-14H,1H3,(H2,23,25,28)
InChIKey VZWIRUQFQUTNQE-UHFFFAOYSA-N
Mol Weight 402.53 g/mol
Molecular Formula C22H18N4S2
Exact Mass 402.097289 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 49bVsB8ssa
Name N'-(4-Methylphenyl)-N-(3-phenyl-4-thioxoquiazolin-3-yl)thiourea
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H18N4S2
InChI InChI=1S/C22H18N4S2/c1-15-11-13-17(14-12-15)23-22(28)25-26-20(16-7-3-2-4-8-16)24-19-10-6-5-9-18(19)21(26)27/h2-14H,1H3,(H2,23,25,28)
InChIKey VZWIRUQFQUTNQE-UHFFFAOYSA-N
Molecular Weight 402.534 g/mol
SMILES N(N1C(=Nc2c(C1=S)cccc2)c1ccccc1)C(Nc1ccc(cc1)C)=S
SPLASH splash10-0a6r-6298000000-1896699295dd719b9fcc
Source of Spectrum SO-0-882-3
Wiley ID 1538250