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CHEBI:107162 - 6-bromo-3-[4-oxo-4-[4-(2-pyridinyl)-1-piperazinyl]butyl]-2-sulfanylidene-1H-quinazolin-4-one

ChEBI IDCHEBI:107162
ChEBI Name6-bromo-3-[4-oxo-4-[4-(2-pyridinyl)-1-piperazinyl]butyl]-2-sulfanylidene-1H-quinazolin-4-one
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DownloadsMolfile
FormulaC21H22BrN5O2S
Net Charge0
Average Mass488.411
Monoisotopic Mass487.06776
SMILESO=C(CCCn1c(=S)nc2ccc(Br)cc2c1=O)N1CCN(c2ccccn2)CC1
InChIInChI=1S/C21H22BrN5O2S/c22-15-6-7-17-16(14-15)20(29)27(21(30)24-17)9-3-5-19(28)26-12-10-25(11-13-26)18-4-1-2-8-23-18/h1-2,4,6-8,14H,3,5,9-13H2,(H,24,30)
InChIKeyJVDAHWMLZLAMIO-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
6-bromo-3-[4-oxo-4-[4-(2-pyridinyl)-1-piperazinyl]butyl]-2-sulfanylidene-1H-quinazolin-4-one (CHEBI:107162) is a piperazines (CHEBI:26144)
6-bromo-3-[4-oxo-4-[4-(2-pyridinyl)-1-piperazinyl]butyl]-2-sulfanylidene-1H-quinazolin-4-one (CHEBI:107162) is a pyridines (CHEBI:26421)
Manual XrefsDatabases
LSM-18516LINCS