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3-Methyl-1,5-diphenyl-4,5,6,7-tetrahydropyrazolo[3,4-d]pyrimidin-6-thione
SpectraBase Compound ID 8OQsXjI0GNw
InChI InChI=1S/C18H16N4S/c1-13-16-12-21(14-8-4-2-5-9-14)18(23)19-17(16)22(20-13)15-10-6-3-7-11-15/h2-11H,12H2,1H3,(H,19,23)
InChIKey XJUGLEXWARMVQX-UHFFFAOYSA-N
Mol Weight 320.41 g/mol
Molecular Formula C18H16N4S
Exact Mass 320.109568 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HJG8Epy8Mxq
Name 3-Methyl-1,5-diphenyl-4,5,6,7-tetrahydropyrazolo[3,4-d]pyrimidin-6-thione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H16N4S
InChI InChI=1S/C18H16N4S/c1-13-16-12-21(14-8-4-2-5-9-14)18(23)19-17(16)22(20-13)15-10-6-3-7-11-15/h2-11H,12H2,1H3,(H,19,23)
InChIKey XJUGLEXWARMVQX-UHFFFAOYSA-N
Molecular Weight 320.414 g/mol
SMILES N1c2c(CN(C1=S)c1ccccc1)c(n[n]2-c1ccccc1)C
SPLASH splash10-00ar-4902000000-413d3f10cffa2c355003
Source of Spectrum SO-0-473-6
Synonyms 3-Methyl-1,5-diphenyl-1,4,5,7-tetrahydro-6H-pyrazolo[3,4-d]pyrimidine-6-thione
Wiley ID 1541456