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Pentanamide, N-[2-chloro-5-[(octylsulfonyl)amino]phenyl]-2-[4-[[(2-hydroxyethyl)amino]sulfonyl]phenoxy]-4,4-dimethyl-3-oxo-
SpectraBase Compound ID JVtkJikgnJG
InChI InChI=1S/C29H42ClN3O8S2/c1-5-6-7-8-9-10-19-42(37,38)33-21-11-16-24(30)25(20-21)32-28(36)26(27(35)29(2,3)4)41-22-12-14-23(15-13-22)43(39,40)31-17-18-34/h11-16,20,26,31,33-34H,5-10,17-19H2,1-4H3,(H,32,36)
InChIKey GYTOCZQMRCWJMX-UHFFFAOYSA-N
Mol Weight 660.2 g/mol
Molecular Formula C29H42ClN3O8S2
Exact Mass 659.210185 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3yfWwfA0tk
Name Pentanamide, N-[2-chloro-5-[(octylsulfonyl)amino]phenyl]-2-[4-[[(2-hydroxyethyl)amino]sulfonyl]phenoxy]-4,4-dimethyl-3-oxo-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C29H42ClN3O8S2
InChI InChI=1S/C29H42ClN3O8S2/c1-5-6-7-8-9-10-19-42(37,38)33-21-11-16-24(30)25(20-21)32-28(36)26(27(35)29(2,3)4)41-22-12-14-23(15-13-22)43(39,40)31-17-18-34/h11-16,20,26,31,33-34H,5-10,17-19H2,1-4H3,(H,32,36)
InChIKey GYTOCZQMRCWJMX-UHFFFAOYSA-N
Molecular Weight 660.241 g/mol
SMILES N(S(CCCCCCCC)(=O)=O)c1ccc(c(c1)NC(C(Oc1ccc(S(=O)(=O)NCCO)cc1)C(=O)C(C)(C)C)=O)Cl
SPLASH splash10-0006-8903000000-e6e3b811fc49bd54e410
Source of Spectrum JX-2015-4-1399
Synonyms N-(2-chloro-5-(octylsulfonamido)phenyl)-2-(4-(N-(2-hydroxyethyl)sulfamoyl)phenoxy)-4,4-dimethyl-3-oxopentanamide N-{2-chloro-5-[(octylsulfonyl)amino]phenyl}-2-{4-[(2-hydroxyethyl)sulfamoyl]phenoxy}-4,4-dimethyl-3-oxopentanamide N-[2-chloro-5-(octylsulfonylamino)phenyl]-2-[4-(2-hydroxyethylsulfamoyl)phenoxy]-4,4-dimethyl-3-oxopentanamide N-[2-chloro-5-(octylsulfonylamino)phenyl]-2-[4-(2-hydroxyethylsulfamoyl)phenoxy]-4,4-dimethyl-3-oxo-pentanamide N-[2-chloranyl-5-(octylsulfonylamino)phenyl]-2-[4-(2-hydroxyethylsulfamoyl)phenoxy]-4,4-dimethyl-3-oxidanylidene-pentanamide
Wiley ID 1726787