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4(N)-(p-Methoxybenzyl)-6-(benzylthio)-2-phenylpyrimidine-4,5-diamine
SpectraBase Compound ID BioteMmV3v8
InChI InChI=1S/C25H24N4OS/c1-30-21-14-12-18(13-15-21)16-27-24-22(26)25(31-17-19-8-4-2-5-9-19)29-23(28-24)20-10-6-3-7-11-20/h2-15H,16-17,26H2,1H3,(H,27,28,29)
InChIKey YVSVNAMGPVWPSI-UHFFFAOYSA-N
Mol Weight 428.55 g/mol
Molecular Formula C25H24N4OS
Exact Mass 428.167083 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DB4zEfiSBj0
Name 4(N)-(p-Methoxybenzyl)-6-(benzylthio)-2-phenylpyrimidine-4,5-diamine
Comments Less than 3 mono-isotopic peaks
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Formula C25H24N4OS
InChI InChI=1S/C25H24N4OS/c1-30-21-14-12-18(13-15-21)16-27-24-22(26)25(31-17-19-8-4-2-5-9-19)29-23(28-24)20-10-6-3-7-11-20/h2-15H,16-17,26H2,1H3,(H,27,28,29)
InChIKey YVSVNAMGPVWPSI-UHFFFAOYSA-N
Molecular Weight 428.554 g/mol
SMILES N(c1nc(nc(c1N)SCc1ccccc1)-c1ccccc1)Cc1ccc(cc1)OC
SPLASH splash10-00di-0900000000-fe6b5becd133e0b8cff7
Source of Spectrum AJ-41-578-7
Synonyms N4-[(4-methoxyphenyl)methyl]-2-phenyl-6-(phenylmethylthio)pyrimidine-4,5-diamine 6-benzylsulfanyl-4-N-[(4-methoxyphenyl)methyl]-2-phenylpyrimidine-4,5-diamine 6-benzylsulfanyl-N4-[(4-methoxyphenyl)methyl]-2-phenyl-pyrimidine-4,5-diamine N4-[(4-methoxyphenyl)methyl]-2-phenyl-6-(phenylmethylsulfanyl)pyrimidine-4,5-diamine
Wiley ID 1567575