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N-{2-[ (4-Methylphenyl)sulfonyl]-4-propyl-1H-pyrrol-3-yl}benzenesulfonamide
SpectraBase Compound ID 9bXmbxaHkH2
InChI InChI=1S/C20H22N2O4S2/c1-3-7-16-14-21-20(27(23,24)17-12-10-15(2)11-13-17)19(16)22-28(25,26)18-8-5-4-6-9-18/h4-6,8-14,21-22H,3,7H2,1-2H3
InChIKey DRFZKYQAHSENBS-UHFFFAOYSA-N
Mol Weight 418.53 g/mol
Molecular Formula C20H22N2O4S2
Exact Mass 418.1021 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DkaRshXxtBc
Name N-{2-[ (4-Methylphenyl)sulfonyl]-4-propyl-1H-pyrrol-3-yl}benzenesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H22N2O4S2
InChI InChI=1S/C20H22N2O4S2/c1-3-7-16-14-21-20(27(23,24)17-12-10-15(2)11-13-17)19(16)22-28(25,26)18-8-5-4-6-9-18/h4-6,8-14,21-22H,3,7H2,1-2H3
InChIKey DRFZKYQAHSENBS-UHFFFAOYSA-N
Literature Reference DOI 10.1002/hlca.201200597
Molecular Weight 418.526 g/mol
SMILES [nH]1cc(c(c1S(c1ccc(cc1)C)(=O)=O)NS(=O)(=O)c1ccccc1)CCC
SPLASH splash10-0006-9800000000-21d62bf376db780c644e
Source of Spectrum H-96-2101-4e
Synonyms N-(4-propyl-2-tosyl-1H-pyrrol-3-yl)benzenesulfonamide
Wiley ID 1784592