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1,2-Dihydro-3-cyano-4-(4-methoxyphenyl)-2-oxo-6-(10H-phenothiazin-2-yl)pyridine
SpectraBase Compound ID Izgb9UWzGvV
InChI InChI=1S/C25H17N3O2S/c1-30-17-9-6-15(7-10-17)18-13-21(28-25(29)19(18)14-26)16-8-11-24-22(12-16)27-20-4-2-3-5-23(20)31-24/h2-13,27H,1H3,(H,28,29)
InChIKey LKXZFGLFGOFTFD-UHFFFAOYSA-N
Mol Weight 423.49 g/mol
Molecular Formula C25H17N3O2S
Exact Mass 423.104148 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Iqbhj0MICcY
Name 1,2-Dihydro-3-cyano-4-(4-methoxyphenyl)-2-oxo-6-(10H-phenothiazin-2-yl)pyridine
Appearance Red crystals
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Formula C25H17N3O2S
InChI InChI=1S/C25H17N3O2S/c1-30-17-9-6-15(7-10-17)18-13-21(28-25(29)19(18)14-26)16-8-11-24-22(12-16)27-20-4-2-3-5-23(20)31-24/h2-13,27H,1H3,(H,28,29)
InChIKey LKXZFGLFGOFTFD-UHFFFAOYSA-N
Instrument Name Kratos and Varian MAT 311A
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3771
Molecular Weight 423.490 g/mol
SMILES N1C(c2cc3c(Sc4c(cccc4)N3)cc2)=CC(=C(C#N)C1=O)c1ccc(cc1)OC
SPLASH splash10-00b9-0000900000-ad94b44fa9e591e887c9
Source of Spectrum Y-57-265-12d
Thin-Layer Chromatography Rf = 0.72, (PE(40-60): EtOAc, 4:1)
Wiley ID 1859770