CHEBI:122043 - 2-(ethylthio)-4-[[5-(2-nitrophenyl)-2-furanyl]methylidene]-5-thiazolone

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 2-(ethylthio)-4-[[5-(2-nitrophenyl)-2-furanyl]methylidene]-5-thiazolone
ChEBI ID CHEBI:122043
Stars This entity has been manually annotated by a third party.
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Formula C16H12N2O4S2
Net Charge 0
Average Mass 360.410
Monoisotopic Mass 360.02385
InChI InChI=1S/C16H12N2O4S2/c1-2-23-16-17-12(15(19)24-16)9-10-7-8-14(22-10)11-5-3-4-6-13(11)18(20)21/h3-9H,2H2,1H3
InChIKey VYSPHADEYKHZOS-UHFFFAOYSA-N
SMILES CCSC1=NC(=CC2=CC=C(O2)C3=CC=CC=C3[N+](=O)[O-])C(=O)S1
ChEBI Ontology
Outgoing 2-(ethylthio)-4-[[5-(2-nitrophenyl)-2-furanyl]methylidene]-5-thiazolone (CHEBI:122043) has functional parent α-amino acid (CHEBI:33704)
2-(ethylthio)-4-[[5-(2-nitrophenyl)-2-furanyl]methylidene]-5-thiazolone (CHEBI:122043) is a organonitrogen compound (CHEBI:35352)
2-(ethylthio)-4-[[5-(2-nitrophenyl)-2-furanyl]methylidene]-5-thiazolone (CHEBI:122043) is a organooxygen compound (CHEBI:36963)
Manual Xref Database
LSM-33486 LINCS
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