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CHEBI:112331 - 1-[4-[4-[[1-(4-chlorophenyl)sulfonylcyclopropyl]-oxomethyl]-1-piperazinyl]phenyl]ethanone

Default Structure
ChEBI IDCHEBI:112331
ChEBI Name1-[4-[4-[[1-(4-chlorophenyl)sulfonylcyclopropyl]-oxomethyl]-1-piperazinyl]phenyl]ethanone
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DownloadsMolfile
FormulaC22H23ClN2O4S
Net Charge0
Average Mass446.956
Monoisotopic Mass446.10671
SMILESCC(=O)c1ccc(N2CCN(C(=O)C3(S(=O)(=O)c4ccc(Cl)cc4)CC3)CC2)cc1
InChIInChI=1S/C22H23ClN2O4S/c1-16(26)17-2-6-19(7-3-17)24-12-14-25(15-13-24)21(27)22(10-11-22)30(28,29)20-8-4-18(23)5-9-20/h2-9H,10-15H2,1H3
InChIKeyMZUHVPWGQTUABI-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
1-[4-[4-[[1-(4-chlorophenyl)sulfonylcyclopropyl]-oxomethyl]-1-piperazinyl]phenyl]ethanone (CHEBI:112331) is a aromatic ketone (CHEBI:76224)
Manual XrefsDatabases
LSM-23743LINCS