N-[4-[3-aminopropyl(p-tolylsulfonyl)amino]butyl]-4-methyl-benzenesulfonamide

SpectraBase Compound ID	DFZfCJVZ4Hd
InChI	InChI=1S/C21H31N3O4S2/c1-18-6-10-20(11-7-18)29(25,26)23-15-3-4-16-24(17-5-14-22)30(27,28)21-12-8-19(2)9-13-21/h6-13,23H,3-5,14-17,22H2,1-2H3
InChIKey	PWHZGWQBVNWQNJ-UHFFFAOYSA-N Google Search
Mol Weight	453.62 g/mol
Molecular Formula	C21H31N3O4S2
Exact Mass	453.175599 g/mol

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SpectraBase Spectrum ID	7yusvtIHXIJ
Name	N-[4-[3-aminopropyl(p-tolylsulfonyl)amino]butyl]-4-methyl-benzenesulfonamide
Alternate Name(s)	N-[4-[3-aminopropyl(tosyl)amino]butyl]-4-methyl-benzenesulfonamide N-[4-[3-aminopropyl-(4-methylphenyl)sulfonylamino]butyl]-4-methylbenzenesulfonamide N-[4-[3-azanylpropyl-(4-methylphenyl)sulfonyl-amino]butyl]-4-methyl-benzenesulfonamide
CAS Registry Number	91652-58-3
Copyright	Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula	C21H31N3O4S2
InChI	InChI=1S/C21H31N3O4S2/c1-18-6-10-20(11-7-18)29(25,26)23-15-3-4-16-24(17-5-14-22)30(27,28)21-12-8-19(2)9-13-21/h6-13,23H,3-5,14-17,22H2,1-2H3
InChIKey	PWHZGWQBVNWQNJ-UHFFFAOYSA-N
Molecular Weight	453.616 g/mol
SMILES	NCCCN(CCCCNS(c1ccc(cc1)C)(=O)=O)S(c1ccc(cc1)C)(=O)=O
SPLASH	splash10-0a4i-9100000000-e43acd8dd79fc1a5e5ff
Source of Spectrum	H-67-2181-0
Wiley ID	1388472