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4,6(1H,5H)-Pyrimidinedione, 5-[[(2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)amino]methylidene]dihydro-2-thioxo-1-(3,4,5-trimethoxyphenyl)-
SpectraBase Compound ID HlzkLXN0rBk
InChI InChI=1S/C25H25N5O6S/c1-14-20(24(33)30(28(14)2)15-9-7-6-8-10-15)26-13-17-22(31)27-25(37)29(23(17)32)16-11-18(34-3)21(36-5)19(12-16)35-4/h6-13,26H,1-5H3,(H,27,31,37)/b17-13+
InChIKey ZGTQNTKZQFBZKU-GHRIWEEISA-N
Mol Weight 523.56 g/mol
Molecular Formula C25H25N5O6S
Exact Mass 523.152555 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CMDy9VPGq4f
Name 4,6(1H,5H)-Pyrimidinedione, 5-[[(2,3-dihydro-1,5-dimethyl-3-oxo-2-phenyl-1H-pyrazol-4-yl)amino]methylidene]dihydro-2-thioxo-1-(3,4,5-trimethoxyphenyl)-
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Formula C25H25N5O6S
InChI InChI=1S/C25H25N5O6S/c1-14-20(24(33)30(28(14)2)15-9-7-6-8-10-15)26-13-17-22(31)27-25(37)29(23(17)32)16-11-18(34-3)21(36-5)19(12-16)35-4/h6-13,26H,1-5H3,(H,27,31,37)/b17-13+
InChIKey ZGTQNTKZQFBZKU-GHRIWEEISA-N
Molecular Weight 523.564 g/mol
SMILES N(C=1C(N(c2ccccc2)N(C1C)C)=O)\C=C\1C(N(C(NC1=O)=S)c1cc(OC)c(c(c1)OC)OC)=O
SPLASH splash10-0a4l-9200000000-e1dd6c78edb8bcd98fc8
Source of Spectrum IY-1-4702-8
Synonyms (5E)-5-[[(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)amino]methylidene]-2-sulfanylidene-1-(3,4,5-trimethoxyphenyl)-1,3-diazinane-4,6-dione (5E)-5-[[(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)amino]methylidene]-2-sulfanylidene-1-(3,4,5-trimethoxyphenyl)-1,3-diazinane-4,6-dione (5E)-5-[[(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)amino]methylene]-2-thioxo-1-(3,4,5-trimethoxyphenyl)hexahydropyrimidine-4,6-dione (5E)-5-[[(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)amino]methylidene]-2-sulfanylidene-1-(3,4,5-trimethoxyphenyl)-1,3-diazinane-4,6-dione
Wiley ID 1655011