CHEBI:107311 - 4-[[(5-methyl-3-isoxazolyl)amino]methylidene]-2-[3-(trifluoromethyl)phenyl]isoquinoline-1,3-dione

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ChEBI Name 4-[[(5-methyl-3-isoxazolyl)amino]methylidene]-2-[3-(trifluoromethyl)phenyl]isoquinoline-1,3-dione
ChEBI ID CHEBI:107311
Stars This entity has been manually annotated by a third party.
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Formula C21H14F3N3O3
Net Charge 0
Average Mass 413.350
Monoisotopic Mass 413.09873
InChI InChI=1S/C21H14F3N3O3/c1-12-9-18(26-30-12)25-11-17-15-7-2-3-8-16(15)19(28)27(20(17)29)14-6-4-5-13(10-14)21(22,23)24/h2-11H,1H3,(H,25,26)
InChIKey FDYWWOBXWBUXPF-UHFFFAOYSA-N
SMILES CC1=CC(=NO1)NC=C2C3=CC=CC=C3C(=O)N(C2=O)C4=CC=CC(=C4)C(F)(F)F
ChEBI Ontology
Outgoing 4-[[(5-methyl-3-isoxazolyl)amino]methylidene]-2-[3-(trifluoromethyl)phenyl]isoquinoline-1,3-dione (CHEBI:107311) is a isoquinolines (CHEBI:24922)
Manual Xref Database
LSM-18665 LINCS
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