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6-Phenylamino-2-(6-methyl-3-methylthio-5-oxo-4,5-dihydro-1,2,4-triazin-4-ylimino)-1,4-diphenyl-1,2-dihydro-1,3,5-triazine

View entire compound with spectra: 1 MS (GC)

6-Phenylamino-2-(6-methyl-3-methylthio-5-oxo-4,5-dihydro-1,2,4-triazin-4-ylimino)-1,4-diphenyl-1,2-dihydro-1,3,5-triazine
SpectraBase Compound ID KCG02yMNcTa
InChI InChI=1S/C26H22N8OS/c1-18-23(35)34(26(36-2)31-30-18)32-25-29-22(19-12-6-3-7-13-19)28-24(27-20-14-8-4-9-15-20)33(25)21-16-10-5-11-17-21/h3-17H,1-2H3,(H,27,28,29,32)
InChIKey HNXLNDBJAFJPKA-UHFFFAOYSA-N
Mol Weight 494.58 g/mol
Molecular Formula C26H22N8OS
Exact Mass 494.163729 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CpMgNOVMVXz
Name 6-Phenylamino-2-(6-methyl-3-methylthio-5-oxo-4,5-dihydro-1,2,4-triazin-4-ylimino)-1,4-diphenyl-1,2-dihydro-1,3,5-triazine
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Formula C26H22N8OS
InChI InChI=1S/C26H22N8OS/c1-18-23(35)34(26(36-2)31-30-18)32-25-29-22(19-12-6-3-7-13-19)28-24(27-20-14-8-4-9-15-20)33(25)21-16-10-5-11-17-21/h3-17H,1-2H3,(H,27,28,29,32)
InChIKey HNXLNDBJAFJPKA-UHFFFAOYSA-N
Molecular Weight 494.577 g/mol
SMILES N(C=1N(\C(N=C(N1)c1ccccc1)=N\N1C(=NN=C(C1=O)C)SC)c1ccccc1)c1ccccc1
SPLASH splash10-0ufr-9807300000-4d798989d9798474178b
Source of Spectrum SO-0-151-4
Synonyms 4-[((2E)-6-anilino-1,4-diphenyl-1,3,5-triazin-2(1H)-ylidene)amino]-6-methyl-3-(methylsulfanyl)-1,2,4-triazin-5(4H)-one
Wiley ID 1539803