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5-Benzoylamino-5-methyl-6-imino-2-thioxo-1,2,5,6-tetrahydro-pyrimidin-4(3H)-one
SpectraBase Compound ID 74qEDO7dNia
InChI InChI=1S/C12H12N4O2S/c1-12(9(13)14-11(19)15-10(12)18)16-8(17)7-5-3-2-4-6-7/h2-6H,1H3,(H,16,17)(H3,13,14,15,18,19)
InChIKey KXMUVNXXSUZLAV-UHFFFAOYSA-N
Mol Weight 276.31 g/mol
Molecular Formula C12H12N4O2S
Exact Mass 276.068097 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AAx2my06Vc
Name 5-Methyl-5-phenylamido-6-imino-2-thioxo-1,2,5,6-tetrahydropyrimidin-4(3H)-one
Alternate Name(s) N-(4-imino-5-methyl-6-oxo-2-thioxohexahydro-5-pyrimidinyl)benzamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12N4O2S
InChI InChI=1S/C12H12N4O2S/c1-12(9(13)14-11(19)15-10(12)18)16-8(17)7-5-3-2-4-6-7/h2-6H,1H3,(H,16,17)(H3,13,14,15,18,19)
InChIKey KXMUVNXXSUZLAV-UHFFFAOYSA-N
Molecular Weight 276.314 g/mol
SMILES N1C(NC(C(C1=N)(NC(=O)c1ccccc1)C)=O)=S
SPLASH splash10-0a4i-0930000000-0254a4a1935c55ada96b
Source of Spectrum KC-0-1002-6
Wiley ID 820563