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1-Butyl-2-(4-methyl-phenylamino)-benzo[4,5]thieno[3,2-d][1,2,4]triazolo[1,5-a]pyrimidin-5(1H)-one
SpectraBase Compound ID 8U8kPhDFvRu
InChI InChI=1S/C22H21N5OS/c1-3-4-13-26-21(23-15-11-9-14(2)10-12-15)25-27-20(28)19-18(24-22(26)27)16-7-5-6-8-17(16)29-19/h5-12H,3-4,13H2,1-2H3,(H,23,25)
InChIKey LWOTYMMUBADFQM-UHFFFAOYSA-N
Mol Weight 403.5 g/mol
Molecular Formula C22H21N5OS
Exact Mass 403.146681 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DU7ew7YZs9u
Name 1-Butyl-2-(4-methyl-phenylamino)-benzo[4,5]thieno[3,2-d][1,2,4]triazolo[1,5-a]pyrimidin-5(1H)-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H21N5OS
InChI InChI=1S/C22H21N5OS/c1-3-4-13-26-21(23-15-11-9-14(2)10-12-15)25-27-20(28)19-18(24-22(26)27)16-7-5-6-8-17(16)29-19/h5-12H,3-4,13H2,1-2H3,(H,23,25)
InChIKey LWOTYMMUBADFQM-UHFFFAOYSA-N
Molecular Weight 403.504 g/mol
SMILES N(C1=NN2C(N1CCCC)=Nc1c(C2=O)sc2ccccc12)c1ccc(cc1)C
SPLASH splash10-0fba-9450500000-a740a12c131fd0a8f88c
Source of Spectrum Y-46-907-7n
Synonyms 3-Butyl-2-p-tolylamino-3H-9-thia-1,3,4,10a-tetraaza-cyclopenta[b]fluoren-10-one
Wiley ID 1666848