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

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ChEBI Name 1-(4-methoxyphenyl)-4-phenyl-2(1H)-pyrimidinethione
ChEBI ID CHEBI:228617
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C17H14N2OS
Net Charge 0
Average Mass 294.370
Monoisotopic Mass 294.08268
InChI InChI=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
InChIKey VQQYBWMOVAGRPP-UHFFFAOYSA-N
SMILES S=C1N(C2=CC=C(OC)C=C2)C=CC(=N1)C3=CC=CC=C3
Metabolite of Species Details
Homo sapiens (NCBI:txid9606) Found in urine (BTO:0001419). See: MetaboLights Study
ChEBI Ontology
Outgoing 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 Xref Database
2090835 ChemSpider
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