CHEBI:125222 - 3-(3-chloro-4-fluorophenyl)-2-(propylthio)-5-(thiophen-2-ylmethylidene)-4-imidazolone

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 3-(3-chloro-4-fluorophenyl)-2-(propylthio)-5-(thiophen-2-ylmethylidene)-4-imidazolone
ChEBI ID CHEBI:125222
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C17H14ClFN2OS2
Net Charge 0
Average Mass 380.890
Monoisotopic Mass 380.02201
InChI InChI=1S/C17H14ClFN2OS2/c1-2-7-24-17-20-15(10-12-4-3-8-23-12)16(22)21(17)11-5-6-14(19)13(18)9-11/h3-6,8-10H,2,7H2,1H3
InChIKey KMTUFOSFWHFIBM-UHFFFAOYSA-N
SMILES CCCSC1=NC(=CC2=CC=CS2)C(=O)N1C3=CC(=C(C=C3)F)Cl
ChEBI Ontology
Outgoing 3-(3-chloro-4-fluorophenyl)-2-(propylthio)-5-(thiophen-2-ylmethylidene)-4-imidazolone (CHEBI:125222) has functional parent α-amino acid (CHEBI:33704)
3-(3-chloro-4-fluorophenyl)-2-(propylthio)-5-(thiophen-2-ylmethylidene)-4-imidazolone (CHEBI:125222) is a organonitrogen compound (CHEBI:35352)
3-(3-chloro-4-fluorophenyl)-2-(propylthio)-5-(thiophen-2-ylmethylidene)-4-imidazolone (CHEBI:125222) is a organooxygen compound (CHEBI:36963)
Manual Xref Database
LSM-36690 LINCS
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