CHEBI:108188 - 1-[2-(diethylsulfamoyl)-4-nitroanilino]-3-(4-fluorophenyl)urea

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 1-[2-(diethylsulfamoyl)-4-nitroanilino]-3-(4-fluorophenyl)urea
ChEBI ID CHEBI:108188
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C17H20FN5O5S
Net Charge 0
Average Mass 425.436
Monoisotopic Mass 425.11692
InChI InChI=1S/C17H20FN5O5S/c1-3-22(4-2)29(27,28)16-11-14(23(25)26)9-10-15(16)20-21-17(24)19-13-7-5-12(18)6-8-13/h5-11,20H,3-4H2,1-2H3,(H2,19,21,24)
InChIKey YWFRZQVGZLTZHX-UHFFFAOYSA-N
SMILES CCN(CC)S(=O)(=O)C1=C(C=CC(=C1)[N+](=O)[O-])NNC(=O)NC2=CC=C(C=C2)F
ChEBI Ontology
Outgoing 1-[2-(diethylsulfamoyl)-4-nitroanilino]-3-(4-fluorophenyl)urea (CHEBI:108188) is a sulfonamide (CHEBI:35358)
Manual Xref Database
LSM-19565 LINCS
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