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4-(2-{[(4,6-Dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]amino}ethyl)benzenesulfonamide
SpectraBase Compound ID C5qpr7IlHwd
InChI InChI=1S/C13H14N4O4S2/c14-23(20,21)9-3-1-8(2-4-9)5-6-15-7-10-11(18)16-13(22)17-12(10)19/h1-4,7,15H,5-6H2,(H2,14,20,21)(H2,16,17,18,19,22)
InChIKey BBZUJBSYBIHPOP-UHFFFAOYSA-N
Mol Weight 354.4 g/mol
Molecular Formula C13H14N4O4S2
Exact Mass 354.045647 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Gtjrxhdwj3E
Name 4-(2-{[(4,6-Dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl]amino}ethyl)benzenesulfonamide
Alternate Name(s) 4-(2-(((4,6-dioxo-2-thioxotetrahydropyrimidin-5(2H)-ylidene)methyl)amino)ethyl)benzenesulfonamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14N4O4S2
InChI InChI=1S/C13H14N4O4S2/c14-23(20,21)9-3-1-8(2-4-9)5-6-15-7-10-11(18)16-13(22)17-12(10)19/h1-4,7,15H,5-6H2,(H2,14,20,21)(H2,16,17,18,19,22)
InChIKey BBZUJBSYBIHPOP-UHFFFAOYSA-N
Molecular Weight 354.399 g/mol
SMILES NS(c1ccc(CCNC=C2C(NC(NC2=O)=S)=O)cc1)(=O)=O
SPLASH splash10-0fw0-0691000000-206b4fdd52f5a2eec5a5
Source of Spectrum QA-58-536-14
Wiley ID 1796570