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6-CYANO-5-(4-METHOXYPHENYL)-2-METHYLSULFANYL-7-PHENYL-5,8-DIHYDROPYRIDO-[2,3-D]-PYRIMIDIN-4(3H)-ONE
SpectraBase Compound ID FRvcSJTL0tb
InChI InChI=1S/C22H18N4O2S/c1-28-15-10-8-13(9-11-15)17-16(12-23)19(14-6-4-3-5-7-14)24-20-18(17)21(27)26-22(25-20)29-2/h3-11,17H,1-2H3,(H2,24,25,26,27)
InChIKey CAVLSXZUYCWYDZ-UHFFFAOYSA-N
Mol Weight 402.47 g/mol
Molecular Formula C22H18N4O2S
Exact Mass 402.115047 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IwuUZsH6u03
Name 4-keto-5-(4-methoxyphenyl)-2-(methylthio)-7-phenyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H18N4O2S
InChI InChI=1S/C22H18N4O2S/c1-28-15-10-8-13(9-11-15)17-16(12-23)19(14-6-4-3-5-7-14)24-20-18(17)21(27)26-22(25-20)29-2/h3-11,17H,1-2H3,(H2,24,25,26,27)
InChIKey CAVLSXZUYCWYDZ-UHFFFAOYSA-N
Molecular Weight 402.472 g/mol
SMILES N1C(C2=C(N=C1SC)NC(=C(C2c1ccc(cc1)OC)C#N)c1ccccc1)=O
SPLASH splash10-0002-0090100000-9b0bf6c20ab61535ec91
Source of Spectrum AJ-43-304-5
Synonyms 5-(4-Methoxyphenyl)-2-(methylthio)-4-oxo-7-phenyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carbonitrile 5-(4-Methoxyphenyl)-2-methylsulfanyl-4-oxidanylidene-7-phenyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carbonitrile 5-(4-Methoxyphenyl)-2-methylsulfanyl-4-oxo-7-phenyl-5,8-dihydro-1H-pyrido[2,3-d]pyrimidine-6-carbonitrile
Wiley ID 1593928