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6-Phenyl-3,5-di-p-tolyl-2-(tosylimino)-2,3-dihydropyrimidin-4(1H)-one
SpectraBase Compound ID 76WBK9ztaST
InChI InChI=1S/C31H27N3O3S/c1-21-9-15-24(16-10-21)28-29(25-7-5-4-6-8-25)32-31(33-38(36,37)27-19-13-23(3)14-20-27)34(30(28)35)26-17-11-22(2)12-18-26/h4-20H,1-3H3,(H,32,33)
InChIKey AIUVVOWUWKODKO-UHFFFAOYSA-N
Mol Weight 521.64 g/mol
Molecular Formula C31H27N3O3S
Exact Mass 521.177313 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4hfyqS6bei
Name 6-Phenyl-3,5-di-p-tolyl-2-(tosylimino)-2,3-dihydropyrimidin-4(1H)-one
Alternate Name(s) N-((2E)-3,5-bis(4-methylphenyl)-4-oxo-6-phenyl-3,4-dihydro-2(1H)-pyrimidinylidene)-4-methylbenzenesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H27N3O3S
InChI InChI=1S/C31H27N3O3S/c1-21-9-15-24(16-10-21)28-29(25-7-5-4-6-8-25)32-31(33-38(36,37)27-19-13-23(3)14-20-27)34(30(28)35)26-17-11-22(2)12-18-26/h4-20H,1-3H3,(H,32,33)
InChIKey AIUVVOWUWKODKO-UHFFFAOYSA-N
Molecular Weight 521.635 g/mol
SMILES N1\C(N(C(C(=C1c1ccccc1)c1ccc(cc1)C)=O)c1ccc(cc1)C)=N/S(c1ccc(cc1)C)(=O)=O
SPLASH splash10-00xr-0004190000-290c36bdbf78fea00204
Source of Spectrum KC-0-3076-11
Wiley ID 826496