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CHEBI:115584 - 4-[2-[[1-(4-chlorophenyl)-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl]thio]-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester

ChEBI IDCHEBI:115584
ChEBI Name4-[2-[[1-(4-chlorophenyl)-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl]thio]-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester
Stars
DownloadsMolfile
FormulaC20H21ClN6O4S
Net Charge0
Average Mass476.946
Monoisotopic Mass476.10335
SMILESCCOC(=O)N1CCN(C(=O)CSc2nc3n(-c4ccc(Cl)cc4)ncc-3c(=O)n2)CC1
InChIInChI=1S/C20H21ClN6O4S/c1-2-31-20(30)26-9-7-25(8-10-26)16(28)12-32-19-23-17-15(18(29)24-19)11-22-27(17)14-5-3-13(21)4-6-14/h3-6,11,22H,2,7-10,12H2,1H3
InChIKeyCSGLLFIDWWVDOV-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
4-[2-[[1-(4-chlorophenyl)-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl]thio]-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester (CHEBI:115584) is a pyrazoles (CHEBI:26410)
4-[2-[[1-(4-chlorophenyl)-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-6-yl]thio]-1-oxoethyl]-1-piperazinecarboxylic acid ethyl ester (CHEBI:115584) is a ring assembly (CHEBI:36820)
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LSM-27041LINCS