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5-Methyl-7-phenyl-6-(1-piperidinylsulfonyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
SpectraBase Compound ID 3aEV0fmKr12
InChI InChI=1S/C17H21N5O2S/c1-13-16(25(23,24)21-10-6-3-7-11-21)15(14-8-4-2-5-9-14)22-17(20-13)18-12-19-22/h2,4-5,8-9,12,15H,3,6-7,10-11H2,1H3,(H,18,19,20)
InChIKey MOGQUMKNPXOXTQ-UHFFFAOYSA-N
Mol Weight 359.45 g/mol
Molecular Formula C17H21N5O2S
Exact Mass 359.141596 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AaBIPzwHOE4
Name 5-Methyl-7-phenyl-6-(1-piperidinylsulfonyl)-4,7-dihydro[1,2,4]triazolo[1,5-a]pyrimidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H21N5O2S
InChI InChI=1S/C17H21N5O2S/c1-13-16(25(23,24)21-10-6-3-7-11-21)15(14-8-4-2-5-9-14)22-17(20-13)18-12-19-22/h2,4-5,8-9,12,15H,3,6-7,10-11H2,1H3,(H,18,19,20)
InChIKey MOGQUMKNPXOXTQ-UHFFFAOYSA-N
Literature Reference DOI 10.1007/s10593-015-1759-5
Molecular Weight 359.448 g/mol
SMILES N1c2[n](C(C(=C1C)S(N1CCCCC1)(=O)=O)c1ccccc1)ncn2
SPLASH splash10-01q9-7793000000-20996f9932850a52360b
Source of Spectrum HC-51-693-4a
Synonyms 5-Methyl-7-phenyl-6-(piperidin-1-ylsulfonyl)-4,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidine
Wiley ID 1800786