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CHEBI:348530 - thiouracil

ChEBI IDCHEBI:348530
ChEBI Namethiouracil
Stars
DefinitionA nucleobase analogue that is uracil in which the oxo group at C-2 is replaced by a thioxo group.
Last Modified22 February 2017
DownloadsMolfile
FormulaC4H4N2OS
Net Charge0
Average Mass128.156
Monoisotopic Mass128.00443
SMILESO=c1ccnc(=S)n1
InChIInChI=1S/C4H4N2OS/c7-3-1-2-5-4(8)6-3/h1-2H,(H2,5,6,7,8)
InChIKeyZEMGGZBWXRYJHK-UHFFFAOYSA-N
Wikipedia
Roles Classification
Biological Roles:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
antithyroid drug  A drug used to treat hyperthyroidism by reducing the excessive production of thyroid hormones.
Application:
antithyroid drug  A drug used to treat hyperthyroidism by reducing the excessive production of thyroid hormones.
ChEBI Ontology
Outgoing Relation(s)
thiouracil (CHEBI:348530) has functional parent uracil (CHEBI:17568)
thiouracil (CHEBI:348530) has role antithyroid drug (CHEBI:50671)
thiouracil (CHEBI:348530) has role metabolite (CHEBI:25212)
thiouracil (CHEBI:348530) is a nucleobase analogue (CHEBI:67142)
thiouracil (CHEBI:348530) is a thiocarbonyl compound (CHEBI:50492)
IUPAC Name 
2-thioxo-2,3-dihydropyrimidin-4(1H)-one
Synonyms  Source
2-Mercapto-pyrimidin-4-olChEMBL
2-Thioxo-2,3-dihydro-1H-pyrimidin-4-oneChEMBL
2-ThiouracilNIST Chemistry WebBook
2-Thio-2,4-(1H,3H)-pyrimidinedioneChemIDplus
2-mercapto-4-pyrimidinolNIST Chemistry WebBook
4-Hydroxy-2-pyrimidinethiolKEGG COMPOUND
Manual XrefsDatabases
ThiouracilWikipedia
C19304KEGG COMPOUND
2640DrugCentral
Registry NumbersSources
Reaxys:112227Reaxys
CAS:141-90-2ChemIDplus
CAS:141-90-2NIST Chemistry WebBook
CAS:141-90-2KEGG COMPOUND
Citations