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1-(3-allyl-4-oxo-3,4-dihydroquinazolin-2-ylthio)-3-phenylurea
SpectraBase Compound ID 2bIupKAJ7Q0
InChI InChI=1S/C18H16N4O2S/c1-2-12-22-16(23)14-10-6-7-11-15(14)20-18(22)25-21-17(24)19-13-8-4-3-5-9-13/h2-11H,1,12H2,(H2,19,21,24)
InChIKey NXISKYJKQQCUNU-UHFFFAOYSA-N
Mol Weight 352.41 g/mol
Molecular Formula C18H16N4O2S
Exact Mass 352.099397 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7TTeVu0t5dA
Name 1-(3-allyl-4-oxo-3,4-dihydroquinazolin-2-ylthio)-3-phenylurea
Alternate Name(s) 1-((3-allyl-4-oxo-3,4-dihydroquinazolin-2-yl)thio)-3-phenylurea
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16N4O2S
InChI InChI=1S/C18H16N4O2S/c1-2-12-22-16(23)14-10-6-7-11-15(14)20-18(22)25-21-17(24)19-13-8-4-3-5-9-13/h2-11H,1,12H2,(H2,19,21,24)
InChIKey NXISKYJKQQCUNU-UHFFFAOYSA-N
Literature Reference DOI 10.1002/prac.19973390129
Molecular Weight 352.412 g/mol
SMILES N(SC1=Nc2ccccc2C(N1CC=C)=O)C(Nc1ccccc1)=O
SPLASH splash10-00kf-6980000000-5e0142a5da2594975025
Source of Spectrum JF-399-155-7a
Wiley ID 1768338