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CHEBI:121737 - 1-phenyl-6-[(2-pyrimidinylthio)methyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one

ChEBI IDCHEBI:121737
ChEBI Name1-phenyl-6-[(2-pyrimidinylthio)methyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one
Stars
DownloadsMolfile
FormulaC16H12N6OS
Net Charge0
Average Mass336.380
Monoisotopic Mass336.07933
SMILESO=c1nc(CSc2ncccn2)nc2n(-c3ccccc3)ncc1-2
InChIInChI=1S/C16H12N6OS/c23-15-12-9-19-22(11-5-2-1-3-6-11)14(12)20-13(21-15)10-24-16-17-7-4-8-18-16/h1-9,19H,10H2
InChIKeyHCOSUQTVWYAZBF-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1-phenyl-6-[(2-pyrimidinylthio)methyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one (CHEBI:121737) is a pyrazoles (CHEBI:26410)
1-phenyl-6-[(2-pyrimidinylthio)methyl]-2H-pyrazolo[3,4-d]pyrimidin-4-one (CHEBI:121737) is a ring assembly (CHEBI:36820)
Manual XrefsDatabases
LSM-33180LINCS