5-Butyl-4,5-dihydrobenzo[f][1,2,3]triazolo[5,1-d][1,2,5]thiadiazepine-1,1-dioxide

SpectraBase Compound ID	FmW8serUL7o
InChI	InChI=1S/C13H16N4O2S/c1-2-3-8-16-10-11-9-14-15-17(11)12-6-4-5-7-13(12)20(16,18)19/h4-7,9H,2-3,8,10H2,1H3
InChIKey	KEBLUSMKUFIIMN-UHFFFAOYSA-N Google Search
Mol Weight	292.36 g/mol
Molecular Formula	C13H16N4O2S
Exact Mass	292.099397 g/mol

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SpectraBase Spectrum ID	DizY54mWOgX
Name	5-Butyl-4,5-dihydrobenzo[f][1,2,3]triazolo[5,1-d][1,2,5]thiadiazepine-1,1-dioxide
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C13H16N4O2S
InChI	InChI=1S/C13H16N4O2S/c1-2-3-8-16-10-11-9-14-15-17(11)12-6-4-5-7-13(12)20(16,18)19/h4-7,9H,2-3,8,10H2,1H3
InChIKey	KEBLUSMKUFIIMN-UHFFFAOYSA-N
Literature Reference DOI	10.1002/adsc.201000465
Molecular Weight	292.357 g/mol
SMILES	c12S(N(Cc3[n](-c2cccc1)nnc3)CCCC)(=O)=O
SPLASH	splash10-0fsi-9770000000-7508f4d499ce56924ea8
Source of Spectrum	ASC-353-41/SM15-9c
Synonyms	5-Butyl-4,5-dihydrobenzo[f][1,2,3]triazolo[5,1-d][1,2,5]thiadiazepine 6,6-dioxide
Wiley ID	1764579