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CHEBI:228617 - 1-(4-methoxyphenyl)-4-phenyl-2(1H)-pyrimidinethione

ChEBI IDCHEBI:228617
ChEBI Name1-(4-methoxyphenyl)-4-phenyl-2(1H)-pyrimidinethione
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC17H14N2OS
Net Charge0
Average Mass294.379
Monoisotopic Mass294.08268
SMILESCOc1ccc(-n2ccc(-c3ccccc3)nc2=S)cc1
InChIInChI=1S/C17H14N2OS/c1-20-15-9-7-14(8-10-15)19-12-11-16(18-17(19)21)13-5-3-2-4-6-13/h2-12H,1H3
InChIKeyVQQYBWMOVAGRPP-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Homo sapiens (ncbitaxon:9606) urine (BTO:0001419) MetaboLights (MTBLS8662)
ChEBI Ontology
Outgoing Relation(s)
1-(4-methoxyphenyl)-4-phenyl-2(1H)-pyrimidinethione (CHEBI:228617) is a pyrimidines (CHEBI:39447)
IUPAC Name 
1-(4-methoxyphenyl)-4-phenylpyrimidine-2-thione
Manual XrefsDatabases
2090835ChemSpider