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4-(4-CHLOROPHENYL)-2,3,6,7-TETRAHYDRO-7-METHYL-8-METHYLTHIO-2-PHENYL-1H-PYRIMIDO-[4,5-B]-[1,4]-DIAZEPIN-6-ONE

Compound with spectra: 1 NMR, and 1 MS (GC)

4-(4-CHLOROPHENYL)-2,3,6,7-TETRAHYDRO-7-METHYL-8-METHYLTHIO-2-PHENYL-1H-PYRIMIDO-[4,5-B]-[1,4]-DIAZEPIN-6-ONE
SpectraBase Compound ID F5iCefHay3O
InChI InChI=1S/C21H19ClN4OS/c1-26-20(27)18-19(25-21(26)28-2)24-17(13-6-4-3-5-7-13)12-16(23-18)14-8-10-15(22)11-9-14/h3-11,17,24H,12H2,1-2H3
InChIKey YCECCLNKJODIRD-UHFFFAOYSA-N
Mol Weight 410.92 g/mol
Molecular Formula C21H19ClN4OS
Exact Mass 410.09681 g/mol

View Spectrum of 4-(4-CHLOROPHENYL)-2,3,6,7-TETRAHYDRO-7-METHYL-8-METHYLTHIO-2-PHENYL-1H-PYRIMIDO-[4,5-B]-[1,4]-DIAZEPIN-6-ONE

MS (GC) Spectrum
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Source of Spectrum Y-31-64-3

View Spectrum of 4-(4-CHLOROPHENYL)-2,3,6,7-TETRAHYDRO-7-METHYL-8-METHYLTHIO-2-PHENYL-1H-PYRIMIDO-[4,5-B]-[1,4]-DIAZEPIN-6-ONE

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent DMSO-D6
  • 2,3,6,7-Tetrahydro-8-methylthio-7-methyl-4-(4'-chlorophenyl)-2-phenyl-1H-pyrimodo[4,5-b]-[1,4]-diazepin-6-one
2,3,6,7-TETRAHYDRO-7-METHYL-8-METHYLTHIO-4-(4-NITROPHENYL)-2-PHENYL-1H-PYRIMIDO-[4,5-B]-[1,4]-DIAZEPIN-6-ONE
4-(4-CHLOROPHENYL)-2,3,6,7-TETRAHYDRO-8-METHOXY-7-METHYL-2-PHENYL-1H-PYRIMIDO-[4,5-B]-[1,4]-DIAZEPIN-6-ONE
3-Methyl-2-(methylthio)-7(S)-phenyl-6-[(S)-1-phenylethyl]-5,6,7,8-tetrahydropyrimido-[4,5-d]pyrimidin-4(3H)-one
3-methyl-2-(methylthio)-7(R)-phenyl-6-[(S)-1-phenylethyl]-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(3H)-one
3-Methyl-2-(methylthio)-7(S)-phenyl-6-((R)-1-phenylethyl)-5,6,7,8-tetrahydropyrimido[4,5-d]pyrimidin-4(3H)-one
3-Methyl-2-(methylthio)-7(R)-phenyl-6-[(R)-1-phenylethyl]-5,6,7,8-tetrahydropyrimido-[4,5-d]pyrimidin-4(3H)-one
3a,6a-dihydro-5-methyl-3-trans-(2-phenylethenyl)-3H,5H-1-phenylylpyrrolo[3,4-c]pyrrol-4,6-dione
benzoic acid, 4-chloro-, 4-[(Z)-(5-imino-2-(1-methylethyl)-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl]-2-methoxyphenyl ester
3-(4-bromophenyl)-5-(2,3-dimethoxyphenyl)-N-phenyl-4,5-dihydro-1H-pyrazole-1-carbothioamide
benzoic acid, 4-[5-[(Z)-(5-imino-2-(1-methylethyl)-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl]-2-furanyl]-, ethyl ester
Title Journal or Book Year
The reaction of aromatic α,β-unsaturated ketones with 4,5-diamino-1,6-dihydropyrimidin-6-ones Journal of Heterocyclic Chemistry 1994
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