CHEBI:109754 - 6-chloro-3-[5-(2,5-dimethoxyphenyl)-1-methylsulfonyl-3-pyrazolidinylidene]-4-phenyl-2-quinolinone

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 6-chloro-3-[5-(2,5-dimethoxyphenyl)-1-methylsulfonyl-3-pyrazolidinylidene]-4-phenyl-2-quinolinone
ChEBI ID CHEBI:109754
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C27H24ClN3O5S
Net Charge 0
Average Mass 538.017
Monoisotopic Mass 537.11252
InChI InChI=1S/C27H24ClN3O5S/c1-35-18-10-12-24(36-2)20(14-18)23-15-22(30-31(23)37(3,33)34)26-25(16-7-5-4-6-8-16)19-13-17(28)9-11-21(19)29-27(26)32/h4-14,23,30H,15H2,1-3H3
InChIKey DFMHFEBWELLLOX-UHFFFAOYSA-N
SMILES COC1=CC(=C(C=C1)OC)C2CC(=C3C(=C4C=C(C=CC4=NC3=O)Cl)C5=CC=CC=C5)NN2S(=O)(=O)C
ChEBI Ontology
Outgoing 6-chloro-3-[5-(2,5-dimethoxyphenyl)-1-methylsulfonyl-3-pyrazolidinylidene]-4-phenyl-2-quinolinone (CHEBI:109754) is a quinolines (CHEBI:26513)
Manual Xref Database
LSM-21182 LINCS
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