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Acetamide, N-[3-[[3-[[4-(acetylamino)butyl][(4-methylphenyl)sulfonyl]amino]propy l][(4-methylphenyl)sulfonyl]amino]propyl]-
SpectraBase Compound ID 9yu6wr3y7wE
InChI InChI=1S/C28H42N4O6S2/c1-23-9-13-27(14-10-23)39(35,36)31(19-6-5-17-29-25(3)33)21-8-22-32(20-7-18-30-26(4)34)40(37,38)28-15-11-24(2)12-16-28/h9-16H,5-8,17-22H2,1-4H3,(H,29,33)(H,30,34)
InChIKey RRDOKARGRPRLFI-UHFFFAOYSA-N
Mol Weight 594.8 g/mol
Molecular Formula C28H42N4O6S2
Exact Mass 594.254577 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I3iItRvfmKC
Name Acetamide, N-[3-[[3-[[4-(acetylamino)butyl][(4-methylphenyl)sulfonyl]amino]propy l][(4-methylphenyl)sulfonyl]amino]propyl]-
CAS Registry Number 62371-93-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H42N4O6S2
InChI InChI=1S/C28H42N4O6S2/c1-23-9-13-27(14-10-23)39(35,36)31(19-6-5-17-29-25(3)33)21-8-22-32(20-7-18-30-26(4)34)40(37,38)28-15-11-24(2)12-16-28/h9-16H,5-8,17-22H2,1-4H3,(H,29,33)(H,30,34)
InChIKey RRDOKARGRPRLFI-UHFFFAOYSA-N
Molecular Weight 594.786 g/mol
SMILES N(C(=O)C)CCCCN(CCCN(CCCNC(=O)C)S(c1ccc(cc1)C)(=O)=O)S(c1ccc(cc1)C)(=O)=O
SPLASH splash10-007o-9511000000-2e347c2e33430f68516a
Source of Spectrum H-60-121-0
Synonyms N-(3-{(3-{[4-(acetylamino)butyl][(4-methylphenyl)sulfonyl]amino}propyl)[(4-methylphenyl)sulfonyl]amino}propyl)acetamide N-(4-acetamidobutyl)-N'-(3-acetamidopropyl)-N,N'-bis(p-tolylsulfonyl)-1,3-diaminopropane
Wiley ID 1409609