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N-[5-Butyl-6-(dimethylamino)-2-(trichloromethyl)-pyrimidin-4-yl]benzenesulfonamide
SpectraBase Compound ID 7LTp48RynPE
InChI InChI=1S/C17H21Cl3N4O2S/c1-4-5-11-13-14(23-27(25,26)12-9-7-6-8-10-12)21-16(17(18,19)20)22-15(13)24(2)3/h6-10H,4-5,11H2,1-3H3,(H,21,22,23)
InChIKey HEDYQGQPNMTYKO-UHFFFAOYSA-N
Mol Weight 451.8 g/mol
Molecular Formula C17H21Cl3N4O2S
Exact Mass 450.04508 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2E44X4zOrBg
Name N-[5-Butyl-6-(dimethylamino)-2-(trichloromethyl)-pyrimidin-4-yl]benzenesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H21Cl3N4O2S
InChI InChI=1S/C17H21Cl3N4O2S/c1-4-5-11-13-14(23-27(25,26)12-9-7-6-8-10-12)21-16(17(18,19)20)22-15(13)24(2)3/h6-10H,4-5,11H2,1-3H3,(H,21,22,23)
InChIKey HEDYQGQPNMTYKO-UHFFFAOYSA-N
Molecular Weight 451.800 g/mol
SMILES N(c1nc(C(Cl)(Cl)Cl)nc(c1CCCC)N(C)C)S(=O)(=O)c1ccccc1
SPLASH splash10-0a4l-3911000000-7a20c7959f338bc8e955
Source of Spectrum F4-24-168-5h
Synonyms N-(5-butyl-6-(dimethylamino)-2-(trichloromethyl)pyrimidin-4-yl)benzenesulfonamide
Wiley ID 1741707