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2-Methoxy-4-(methylsulfanyl)-N-{2-[4-(1-pyrrolidinylsulfonyl)phenyl]ethyl}benzamide
SpectraBase Compound ID hXJdpTWBix
InChI InChI=1S/C21H26N2O4S2/c1-27-20-15-17(28-2)7-10-19(20)21(24)22-12-11-16-5-8-18(9-6-16)29(25,26)23-13-3-4-14-23/h5-10,15H,3-4,11-14H2,1-2H3,(H,22,24)
InChIKey WDNGERYOFXCENP-UHFFFAOYSA-N
Mol Weight 434.57 g/mol
Molecular Formula C21H26N2O4S2
Exact Mass 434.1334 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H9Cqs52JJbb
Name 2-Methoxy-4-(methylsulfanyl)-N-{2-[4-(1-pyrrolidinylsulfonyl)phenyl]ethyl}benzamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H26N2O4S2
InChI InChI=1S/C21H26N2O4S2/c1-27-20-15-17(28-2)7-10-19(20)21(24)22-12-11-16-5-8-18(9-6-16)29(25,26)23-13-3-4-14-23/h5-10,15H,3-4,11-14H2,1-2H3,(H,22,24)
InChIKey WDNGERYOFXCENP-UHFFFAOYSA-N
Molecular Weight 434.569 g/mol
SMILES N(C(c1c(cc(cc1)SC)OC)=O)CCc1ccc(S(N2CCCC2)(=O)=O)cc1
SPLASH splash10-001i-2902000000-7306f3c9dd772db0f380
Synonyms 2-Methoxy-4-(methylthio)-N-[2-(4-pyrrolidinosulfonylphenyl)ethyl]benzamide 2-Methoxy-4-(methylthio)-N-[2-[4-(1-pyrrolidinylsulfonyl)phenyl]ethyl]benzamide 2-Methoxy-4-methylsulfanyl-N-[2-(4-pyrrolidin-1-ylsulfonylphenyl)ethyl]benzamide
Wiley ID 1462025