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6-(4-Methoxyphenylamino)-2-(6-methyl-3-methylthio-5-oxo-4,5-dihydro-1,2,4-triazin-4-ylimino)-1-(4-methoxyphenyl)-4-(4-nitrophenyl)-1,2-dihydro-1,3,5-triazine

View entire compound with spectra: 1 MS (GC)

6-(4-Methoxyphenylamino)-2-(6-methyl-3-methylthio-5-oxo-4,5-dihydro-1,2,4-triazin-4-ylimino)-1-(4-methoxyphenyl)-4-(4-nitrophenyl)-1,2-dihydro-1,3,5-triazine
SpectraBase Compound ID Eq41CIWhYeN
InChI InChI=1S/C28H25N9O5S/c1-17-25(38)36(28(43-4)33-32-17)34-27-31-24(18-5-9-21(10-6-18)37(39)40)30-26(29-19-7-13-22(41-2)14-8-19)35(27)20-11-15-23(42-3)16-12-20/h5-16H,1-4H3,(H,29,30,31,34)
InChIKey NKRQXVFCWJPJEC-UHFFFAOYSA-N
Mol Weight 599.63 g/mol
Molecular Formula C28H25N9O5S
Exact Mass 599.169936 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7hknNtnJomX
Name 6-(4-Methoxyphenylamino)-2-(6-methyl-3-methylthio-5-oxo-4,5-dihydro-1,2,4-triazin-4-ylimino)-1-(4-methoxyphenyl)-4-(4-nitrophenyl)-1,2-dihydro-1,3,5-triazine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H25N9O5S
InChI InChI=1S/C28H25N9O5S/c1-17-25(38)36(28(43-4)33-32-17)34-27-31-24(18-5-9-21(10-6-18)37(39)40)30-26(29-19-7-13-22(41-2)14-8-19)35(27)20-11-15-23(42-3)16-12-20/h5-16H,1-4H3,(H,29,30,31,34)
InChIKey NKRQXVFCWJPJEC-UHFFFAOYSA-N
Molecular Weight 599.626 g/mol
SMILES N(C=1N(\C(N=C(N1)c1ccc(cc1)N(=O)=O)=N\N1C(=NN=C(C1=O)C)SC)c1ccc(cc1)OC)c1ccc(cc1)OC
SPLASH splash10-0002-5900000000-a25db60bff62f9da6b9e
Source of Spectrum SO-0-151-4
Synonyms 4-[((2E)-6-(4-methoxyanilino)-1-(4-methoxyphenyl)-4-(4-nitrophenyl)-1,3,5-triazin-2(1H)-ylidene)amino]-6-methyl-3-(methylsulfanyl)-1,2,4-triazin-5(4H)-one
Wiley ID 1539795