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4,6(1H,5H)-pyrimidinedione, 1,3-diethyldihydro-5-[[1-(4-nitrophenyl)-1H-pyrrol-2-yl]methylene]-2-thioxo-
SpectraBase Compound ID 6BaJwju6Pzq
InChI InChI=1S/C19H18N4O4S/c1-3-20-17(24)16(18(25)21(4-2)19(20)28)12-15-6-5-11-22(15)13-7-9-14(10-8-13)23(26)27/h5-12H,3-4H2,1-2H3
InChIKey YFLNINULKXAIPG-UHFFFAOYSA-N
Mol Weight 398.44 g/mol
Molecular Formula C19H18N4O4S
Exact Mass 398.104876 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1mGR31MmhDI
Name 1,3-Diethyl-5-[[1-(4-nitrophenyl)-2-pyrrolyl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H18N4O4S
InChI InChI=1S/C19H18N4O4S/c1-3-20-17(24)16(18(25)21(4-2)19(20)28)12-15-6-5-11-22(15)13-7-9-14(10-8-13)23(26)27/h5-12H,3-4H2,1-2H3
InChIKey YFLNINULKXAIPG-UHFFFAOYSA-N
Molecular Weight 398.437 g/mol
SMILES C1(C(N(CC)C(N(C1=O)CC)=S)=O)=Cc1[n](-c2ccc(N(=O)=O)cc2)ccc1
SPLASH splash10-014m-6669000000-76f76d0bf1ea7ed51856
Synonyms 1,3-Diethyl-5-[[1-(4-nitrophenyl)pyrrol-2-yl]methylene]-2-thioxo-hexahydropyrimidine-4,6-dione 1,3-Diethyl-5-[[1-(4-nitrophenyl)pyrrol-2-yl]methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone 1,3-Diethyl-5-[[1-(4-nitrophenyl)pyrrol-2-yl]methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione
Wiley ID 1458240