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6-CYANO-2-METHYLSULFANYL-5,7-DIPHENYL-5,8-DIHYDROPYRIDO-[2,3-D]-PYRIMIDIN-4(3H)-ONE
SpectraBase Compound ID E3IC29jT2CY
InChI InChI=1S/C21H16N4OS/c1-27-21-24-19-17(20(26)25-21)16(13-8-4-2-5-9-13)15(12-22)18(23-19)14-10-6-3-7-11-14/h2-11,16H,1H3,(H2,23,24,25,26)
InChIKey ZGGULVSKBDHLQK-UHFFFAOYSA-N
Mol Weight 372.45 g/mol
Molecular Formula C21H16N4OS
Exact Mass 372.104482 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Hz7Gyee9BSG
Name 6-Cyano-5,7-diphenyl-2-(methylsulfanyl)-5,8-dihydropyrido[2,3-d]pyrimidin-4(3H)-one
Alternate Name(s) 2-(methylsulfanyl)-4-oxo-5,7-diphenyl-3,4,5,8-tetrahydropyrido[2,3-d]pyrimidine-6-carbonitrile 2-(methylthio)-4-oxo-5,7-diphenyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carbonitrile 2-Methylsulfanyl-4-oxo-5,7-diphenyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carbonitrile 2-Methylsulfanyl-4-oxidanylidene-5,7-diphenyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carbonitrile
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Formula C21H16N4OS
InChI InChI=1S/C21H16N4OS/c1-27-21-24-19-17(20(26)25-21)16(13-8-4-2-5-9-13)15(12-22)18(23-19)14-10-6-3-7-11-14/h2-11,16H,1H3,(H2,23,24,25,26)
InChIKey ZGGULVSKBDHLQK-UHFFFAOYSA-N
Molecular Weight 372.446 g/mol
SMILES N1C(C2=C(N=C1SC)NC(=C(C2c1ccccc1)C#N)c1ccccc1)=O
SPLASH splash10-0002-3090000000-24461663e6f5177baa3a
Source of Spectrum AJ-43-304-5
Wiley ID 1593926