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(5E)-1-(4-Chlorophenyl)-5-(1H-pyrrol-2-ylmethylene)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
SpectraBase Compound ID G6OSJD9UwST
InChI InChI=1S/C15H10ClN3O2S/c16-9-3-5-11(6-4-9)19-14(21)12(13(20)18-15(19)22)8-10-2-1-7-17-10/h1-8,17H,(H,18,20,22)/b12-8+
InChIKey TZIACVAYKVLEBG-XYOKQWHBSA-N
Mol Weight 331.78 g/mol
Molecular Formula C15H10ClN3O2S
Exact Mass 331.018225 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KUC27sAb7vB
Name (5E)-1-(4-Chlorophenyl)-5-(1H-pyrrol-2-ylmethylene)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
CAS Registry Number 346642-34-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H10ClN3O2S
InChI InChI=1S/C15H10ClN3O2S/c16-9-3-5-11(6-4-9)19-14(21)12(13(20)18-15(19)22)8-10-2-1-7-17-10/h1-8,17H,(H,18,20,22)/b12-8+
InChIKey TZIACVAYKVLEBG-XYOKQWHBSA-N
Molecular Weight 331.777 g/mol
SMILES N1C(\C(=C/c2[nH]ccc2)C(N(C1=S)c1ccc(cc1)Cl)=O)=O
SPLASH splash10-001i-8905000000-99d661ff388f21caba4f
Source of Spectrum AD-0-2532-0
Synonyms (5E)-1-(4-chlorophenyl)-5-(1H-pyrrol-2-ylmethylene)-2-thioxo-hexahydropyrimidine-4,6-dione (5E)-1-(4-chlorophenyl)-5-(1H-pyrrol-2-ylmethylene)-2-thioxo-hexahydropyrimidine-4,6-quinone (5E)-1-(4-chlorophenyl)-5-(1H-pyrrol-2-ylmethylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione Pyrimidine-4,6-dione, hexahydro-1-(4-chlorophenyl)-3-(2-pyrrolylmethylene)-6-thioxo-
Wiley ID 1430993