CHEBI:114224 - 2-[[4-amino-5-(4-bromophenyl)-6-pyrazolo[3,4-d]pyrimidinyl]thio]-1-(4-bromophenyl)ethanone

ChEBI IDCHEBI:114224
ChEBI Name2-[[4-amino-5-(4-bromophenyl)-6-pyrazolo[3,4-d]pyrimidinyl]thio]-1-(4-bromophenyl)ethanone
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FormulaC19H13Br2N5OS
Net Charge0
Average Mass519.222
Monoisotopic Mass516.92076
SMILESNc1c2cnnc-2nc(SCC(=O)c2ccc(Br)cc2)n1-c1ccc(Br)cc1
InChIInChI=1S/C19H13Br2N5OS/c20-12-3-1-11(2-4-12)16(27)10-28-19-24-18-15(9-23-25-18)17(22)26(19)14-7-5-13(21)6-8-14/h1-9H,10,22H2
InChIKeyBDSDAYGNIWJNKN-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
2-[[4-amino-5-(4-bromophenyl)-6-pyrazolo[3,4-d]pyrimidinyl]thio]-1-(4-bromophenyl)ethanone (CHEBI:114224) is a aromatic ketone (CHEBI:76224)
Manual XrefsDatabases
LSM-25685LINCS