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CHEBI:93660 - 1-tert-butyl-5-[(2-chloro-6-fluoro-3-methylphenyl)methyl]-4-pyrazolo[3,4-d]pyrimidinone

Default Structure
ChEBI IDCHEBI:93660
ChEBI Name1-tert-butyl-5-[(2-chloro-6-fluoro-3-methylphenyl)methyl]-4-pyrazolo[3,4-d]pyrimidinone
Stars
DownloadsMolfile
FormulaC17H18ClFN4O
Net Charge0
Average Mass348.809
Monoisotopic Mass348.11532
SMILESCc1ccc(F)c(Cn2cnc3c(cnn3C(C)(C)C)c2=O)c1Cl
InChIInChI=1S/C17H18ClFN4O/c1-10-5-6-13(19)12(14(10)18)8-22-9-20-15-11(16(22)24)7-21-23(15)17(2,3)4/h5-7,9H,8H2,1-4H3
InChIKeyQWWCIRXWIIQFGA-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1-tert-butyl-5-[(2-chloro-6-fluoro-3-methylphenyl)methyl]-4-pyrazolo[3,4-d]pyrimidinone (CHEBI:93660) is a pyrazolopyrimidine (CHEBI:38669)
Manual XrefsDatabases
LSM-4134LINCS