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(5E)-5-(3-Furylmethylene)-1-(4-methylphenyl)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
SpectraBase Compound ID JlGrtlbW9x
InChI InChI=1S/C16H12N2O3S/c1-10-2-4-12(5-3-10)18-15(20)13(14(19)17-16(18)22)8-11-6-7-21-9-11/h2-9H,1H3,(H,17,19,22)/b13-8+
InChIKey BLHNSZIUBRQFRR-MDWZMJQESA-N
Mol Weight 312.34 g/mol
Molecular Formula C16H12N2O3S
Exact Mass 312.056863 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9LuvwNgfZ1f
Name (5E)-5-(3-Furylmethylene)-1-(4-methylphenyl)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione
CAS Registry Number 346612-53-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H12N2O3S
InChI InChI=1S/C16H12N2O3S/c1-10-2-4-12(5-3-10)18-15(20)13(14(19)17-16(18)22)8-11-6-7-21-9-11/h2-9H,1H3,(H,17,19,22)/b13-8+
InChIKey BLHNSZIUBRQFRR-MDWZMJQESA-N
Molecular Weight 312.343 g/mol
SMILES N1C(\C(C(N(C1=S)c1ccc(cc1)C)=O)=C\c1cocc1)=O
SPLASH splash10-03dl-9601000000-2027318ea85f056e192f
Source of Spectrum AD-0-2532-0
Synonyms (5E)-5-(3-furanylmethylidene)-1-(4-methylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione (5E)-5-(3-furfurylidene)-1-(p-tolyl)-2-thioxo-hexahydropyrimidine-4,6-quinone (5E)-5-(3-furylmethylene)-1-(p-tolyl)-2-thioxo-hexahydropyrimidine-4,6-dione (5E)-5-(furan-3-ylmethylidene)-1-(4-methylphenyl)-2-sulfanylidene-1,3-diazinane-4,6-dione Pyrimidine-4,6(3H,5H)-dione, 1,2-dihydro-5-(2-furfurylidene)-1-(4-methylphenyl)-2-thioxo-
Wiley ID 1429691