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Benzenesulfonamide, N-(3-aminopropyl)-4-methyl-N-[3-[[(4-methylphenyl)sulfonyl][3-(2-oxoazacyclotridec-1-yl)propyl]amino]propyl]-
SpectraBase Compound ID 8PrseyWnhVj
InChI InChI=1S/C35H56N4O5S2/c1-31-16-20-33(21-17-31)45(41,42)38(27-12-24-36)29-14-30-39(46(43,44)34-22-18-32(2)19-23-34)28-13-26-37-25-11-9-7-5-3-4-6-8-10-15-35(37)40/h16-23H,3-15,24-30,36H2,1-2H3
InChIKey LSCGWDJOPYYCKP-UHFFFAOYSA-N
Mol Weight 677.0 g/mol
Molecular Formula C35H56N4O5S2
Exact Mass 676.369213 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AGYFDHxZ9xM
Name Benzenesulfonamide, N-(3-aminopropyl)-4-methyl-N-[3-[[(4-methylphenyl)sulfonyl][3-(2-oxoazacyclotridec-1-yl)propyl]amino]propyl]-
CAS Registry Number 75422-06-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C35H56N4O5S2
InChI InChI=1S/C35H56N4O5S2/c1-31-16-20-33(21-17-31)45(41,42)38(27-12-24-36)29-14-30-39(46(43,44)34-22-18-32(2)19-23-34)28-13-26-37-25-11-9-7-5-3-4-6-8-10-15-35(37)40/h16-23H,3-15,24-30,36H2,1-2H3
InChIKey LSCGWDJOPYYCKP-UHFFFAOYSA-N
Molecular Weight 676.976 g/mol
SMILES NCCCN(CCCN(CCCN1CCCCCCCCCCCC1=O)S(c1ccc(C)cc1)(=O)=O)S(c1ccc(C)cc1)(=O)=O
SPLASH splash10-00rf-4390000000-ee2cab49203f46688d30
Source of Spectrum H-62-814-0
Synonyms N-(3-((3-Aminopropyl)[(4-methylphenyl)sulfonyl]amino)propyl)-4-methyl-N-[3-(2-oxoazacyclotridecan-1-yl)propyl]benzenesulfonamide N-(11-Amino-4,8-ditosyl-4,8-diazaundecyl)-12-dodecanolactam N-(3-aminopropyl)-4-methyl-N-[3-[(4-methylphenyl)sulfonyl-[3-(2-oxo-azacyclotridec-1-yl)propyl]amino]propyl]benzenesulfonamide N-(3-aminopropyl)-4-methyl-N-[3-[3-(2-oxo-azacyclotridec-1-yl)propyl-(p-tolylsulfonyl)amino]propyl]benzenesulfonamide N-(3-aminopropyl)-N-[3-[3-(2-keto-azacyclotridec-1-yl)propyl-tosyl-amino]propyl]-4-methyl-benzenesulfonamide N-(3-azanylpropyl)-4-methyl-N-[3-[(4-methylphenyl)sulfonyl-[3-(2-oxidanylidene-1-azacyclotridec-1-yl)propyl]amino]propyl]benzenesulfonamide
Wiley ID 1414165