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5-Amino-4-phenyl-2-p-tolylamino-thieno[2,3-d]pyrimidine-6-carbonitrile
SpectraBase Compound ID 6pn28xrRC87
InChI InChI=1S/C20H15N5S/c1-12-7-9-14(10-8-12)23-20-24-18(13-5-3-2-4-6-13)16-17(22)15(11-21)26-19(16)25-20/h2-10H,22H2,1H3,(H,23,24,25)
InChIKey UVPGQUQTKQYOAM-UHFFFAOYSA-N
Mol Weight 357.44 g/mol
Molecular Formula C20H15N5S
Exact Mass 357.104817 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KLpGhgUMjDi
Name 5-Amino-4-phenyl-2-p-tolylamino-thieno[2,3-d]pyrimidine-6-carbonitrile
Appearance Yellow crystals
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H15N5S
InChI InChI=1S/C20H15N5S/c1-12-7-9-14(10-8-12)23-20-24-18(13-5-3-2-4-6-13)16-17(22)15(11-21)26-19(16)25-20/h2-10H,22H2,1H3,(H,23,24,25)
InChIKey UVPGQUQTKQYOAM-UHFFFAOYSA-N
Instrument Name JEOL JMS-600
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3056
Molecular Weight 357.435 g/mol
SMILES N(c1nc(c2c(c(sc2n1)C#N)N)-c1ccccc1)c1ccc(cc1)C
SPLASH splash10-0a4i-2984000000-cc99fa12fd26c1a24e4b
Source of Spectrum Y-55-SM2-9
Wiley ID 1880770