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2-(1-Benzenesulfonyl-3,5-dimethyl-1H-pyrazol-4-ylsulfanyl)-4-pyridin-3-yl-pyrimidine
SpectraBase Compound ID BgTNk9ArfLH
InChI InChI=1S/C20H17N5O2S2/c1-14-19(15(2)25(24-14)29(26,27)17-8-4-3-5-9-17)28-20-22-12-10-18(23-20)16-7-6-11-21-13-16/h3-13H,1-2H3
InChIKey STUJXVGVSVOASZ-UHFFFAOYSA-N
Mol Weight 423.51 g/mol
Molecular Formula C20H17N5O2S2
Exact Mass 423.082367 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID APXFqAJNQMw
Name 2-(1-Benzenesulfonyl-3,5-dimethyl-1H-pyrazol-4-ylsulfanyl)-4-pyridin-3-yl-pyrimidine
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H17N5O2S2
InChI InChI=1S/C20H17N5O2S2/c1-14-19(15(2)25(24-14)29(26,27)17-8-4-3-5-9-17)28-20-22-12-10-18(23-20)16-7-6-11-21-13-16/h3-13H,1-2H3
InChIKey STUJXVGVSVOASZ-UHFFFAOYSA-N
Molecular Weight 423.509 g/mol
SMILES c1ccc(S([n]2c(c(Sc3nc(-c4cnccc4)ccn3)c(n2)C)C)(=O)=O)cc1
SPLASH splash10-001i-4390000000-82ff74c4480d58e9d130
Synonyms 2-{[3,5-dimethyl-1-(phenylsulfonyl)-1H-pyrazol-4-yl]sulfanyl}-4-(3-pyridinyl)pyrimidine 3,5-Dimethyl-1-(phenylsulfonyl)-1H-pyrazol-4-yl 4-(3-pyridinyl)-2-pyrimidinyl sulfide
Wiley ID 1447085