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Benzenesulfonamide, 4-methyl-N-[3-[[(4-methylphenyl)sulfonyl]amino]propyl]-N-[3-(2-oxoazacyclotridec-1-yl)propyl]-
SpectraBase Compound ID 3Dqb6ECXCQE
InChI InChI=1S/C32H49N3O5S2/c1-28-15-19-30(20-16-28)41(37,38)33-23-12-26-35(42(39,40)31-21-17-29(2)18-22-31)27-13-25-34-24-11-9-7-5-3-4-6-8-10-14-32(34)36/h15-22,33H,3-14,23-27H2,1-2H3
InChIKey LMGYFQMBUGESQI-UHFFFAOYSA-N
Mol Weight 619.9 g/mol
Molecular Formula C32H49N3O5S2
Exact Mass 619.311364 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID F3IjjStOoOC
Name Benzenesulfonamide, 4-methyl-N-[3-[[(4-methylphenyl)sulfonyl]amino]propyl]-N-[3-(2-oxoazacyclotridec-1-yl)propyl]-
CAS Registry Number 65545-59-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H49N3O5S2
InChI InChI=1S/C32H49N3O5S2/c1-28-15-19-30(20-16-28)41(37,38)33-23-12-26-35(42(39,40)31-21-17-29(2)18-22-31)27-13-25-34-24-11-9-7-5-3-4-6-8-10-14-32(34)36/h15-22,33H,3-14,23-27H2,1-2H3
InChIKey LMGYFQMBUGESQI-UHFFFAOYSA-N
Molecular Weight 619.880 g/mol
SMILES N(CCCN(CCCN1CCCCCCCCCCCC1=O)S(c1ccc(C)cc1)(=O)=O)S(c1ccc(C)cc1)(=O)=O
SPLASH splash10-01oy-7982000000-81f6d250e09077e55468
Source of Spectrum H-61-1351-0
Synonyms 4-Methyl-N-(3-([(4-methylphenyl)sulfonyl]amino)propyl)-N-[3-(2-oxoazacyclotridecan-1-yl)propyl]benzenesulfonamide 13-(7-Tosylamino-4-tosyl-4-azaheptyl)-12-dodecanolactam 4-Methyl-N-[3-[(4-methylphenyl)sulfonyl-[3-(2-oxidanylidene-1-azacyclotridec-1-yl)propyl]amino]propyl]benzenesulfonamide 4-Methyl-N-[3-[(4-methylphenyl)sulfonyl-[3-(2-oxo-azacyclotridec-1-yl)propyl]amino]propyl]benzenesulfonamide 4-Methyl-N-[3-[3-(2-oxo-azacyclotridec-1-yl)propyl-(p-tolylsulfonyl)amino]propyl]benzenesulfonamide Azacyclotridecane, benzenesulfonamide deriv. N-[3-[3-(2-keto-azacyclotridec-1-yl)propyl-tosyl-amino]propyl]-4-methyl-benzenesulfonamide
Wiley ID 1411488