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2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-ylthio)-N-o-tolylacetamide
SpectraBase Compound ID 4r7dOGUtp6n
InChI InChI=1S/C16H17N5OS/c1-10-6-4-5-7-13(10)18-14(22)9-23-16-19-15-17-11(2)8-12(3)21(15)20-16/h4-8H,9H2,1-3H3,(H,18,22)
InChIKey XEOLLMYFIPCWPJ-UHFFFAOYSA-N
Mol Weight 327.41 g/mol
Molecular Formula C16H17N5OS
Exact Mass 327.115381 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3REs8GOkhU
Name 2-(5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-ylthio)-N-o-tolylacetamide
Alternate Name(s) 2-((5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)thio)-N-(o-tolyl)acetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H17N5OS
InChI InChI=1S/C16H17N5OS/c1-10-6-4-5-7-13(10)18-14(22)9-23-16-19-15-17-11(2)8-12(3)21(15)20-16/h4-8H,9H2,1-3H3,(H,18,22)
InChIKey XEOLLMYFIPCWPJ-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hc.1075
Molecular Weight 327.406 g/mol
SMILES N(C(CSc1nc2N=C(C=C(C)[n]2n1)C)=O)c1ccccc1C
SPLASH splash10-052g-1911000000-b056803e0b351704d441
Source of Spectrum HAC-12-494-3c
Wiley ID 1783360