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(E)-7-Ethyl-9-(4-methylbenzylidene)-2-(methylthio)-5-(p-tolyl)-6,7,8,9-tetrahydropyrimido[4,5-b][1,6]naphthyridin-4(3H,5H,10H)-one
SpectraBase Compound ID I2n24ceWGb3
InChI InChI=1S/C28H30N4OS/c1-5-32-15-21(14-19-10-6-17(2)7-11-19)25-22(16-32)23(20-12-8-18(3)9-13-20)24-26(29-25)30-28(34-4)31-27(24)33/h6-14,23H,5,15-16H2,1-4H3,(H2,29,30,31,33)/b21-14+
InChIKey YWLRIYDCQWEVLA-KGENOOAVSA-N
Mol Weight 470.64 g/mol
Molecular Formula C28H30N4OS
Exact Mass 470.214033 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CrrxylNQTaR
Name (E)-7-Ethyl-9-(4-methylbenzylidene)-2-(methylthio)-5-(p-tolyl)-6,7,8,9-tetrahydropyrimido[4,5-b][1,6]naphthyridin-4(3H,5H,10H)-one
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Formula C28H30N4OS
InChI InChI=1S/C28H30N4OS/c1-5-32-15-21(14-19-10-6-17(2)7-11-19)25-22(16-32)23(20-12-8-18(3)9-13-20)24-26(29-25)30-28(34-4)31-27(24)33/h6-14,23H,5,15-16H2,1-4H3,(H2,29,30,31,33)/b21-14+
InChIKey YWLRIYDCQWEVLA-KGENOOAVSA-N
Molecular Weight 470.635 g/mol
SMILES N1C(C=2C(C3=C(\C(CN(C3)CC)=C\c3ccc(cc3)C)NC2N=C1SC)c1ccc(cc1)C)=O
SPLASH splash10-0lxt-0940000000-97c7fccd596e9ffc225f
Source of Spectrum EMC-60-6-5d
Synonyms (E)-7-Ethyl-9-(4-methylbenzylidene)-2-(methylthio)-5-(ptolyl)-6,7,8,9-tetrahydropyrimido[4,5-b][1,6]naphthyridin-4(3H,5H,10H)-one (E)-7-ethyl-9-(4-methylbenzylidene)-2-(methylthio)-5-(p-tolyl)-5,6,7,8,9,10-hexahydropyrimido[4,5-b][1,6]naphthyridin-4(3H)-one (9E)-7-ethyl-5-(4-methylphenyl)-9-[(4-methylphenyl)methylidene]-2-(methylthio)-5,6,8,10-tetrahydro-1H-pyrimido[4,5-b][1,6]naphthyridin-4-one (9E)-7-ethyl-2-methylsulfanyl-5-(p-tolyl)-9-(p-tolylmethylene)-5,6,8,10-tetrahydro-1H-pyrimido[4,5-b][1,6]naphthyridin-4-one (9E)-7-ethyl-5-(4-methylphenyl)-9-[(4-methylphenyl)methylidene]-2-methylsulfanyl-5,6,8,10-tetrahydro-1H-pyrimido[4,5-b][1,6]naphthyridin-4-one
Wiley ID 1735390