CHEBI:229770 - iofensulfuron

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ChEBI Name iofensulfuron ChEBI ID CHEBI:229770 Definition An N-sulfonylurea that is N-carbamoyl-2-iodobenzenesulfonamide bearing a 4-methoxy-6-methyl-1,3,5-triazin-2-yl substituent at position N3. Stars This entity has been manually annotated by the ChEBI Team. Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C12H12IN5O4S Net Charge 0 Average Mass 449.220 Monoisotopic Mass 448.96547 InChI InChI=1S/C12H12IN5O4S/c1-7-14-10(17-12(15-7)22-2)16-11(19)18-23(20,21)9-6-4-3-5-8(9)13/h3-6H,1-2H3,(H2,14,15,16,17,18,19) InChIKey VQHHIQJPQOLZGF-UHFFFAOYSA-N SMILES COC1=NC(C)=NC(NC(=O)NS(=O)(=O)C2=CC=CC=C2I)=N1 Roles Classification Application(s): herbicide A substance used to destroy plant pests. View more via ChEBI Ontology ChEBI Ontology Outgoing iofensulfuron (CHEBI:229770) has role herbicide (CHEBI:24527) iofensulfuron (CHEBI:229770) is a N-sulfonylurea (CHEBI:76983) iofensulfuron (CHEBI:229770) is a methoxy-1,3,5-triazine (CHEBI:38177) iofensulfuron (CHEBI:229770) is a organoiodine compound (CHEBI:37142) iofensulfuron (CHEBI:229770) is conjugate acid of iofensulfuron(1−) (CHEBI:229771) Incoming iofensulfuron(1−) (CHEBI:229771) is conjugate base of iofensulfuron (CHEBI:229770) IUPAC Name 2-iodo-N-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]benzenesulfonamide Synonyms Sources 1-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)-3-(2-iodophenylsulfonyl)urea ChEBI 1-[(2-iodophenyl)sulfonyl]-3-(4-methoxy-6-methyl-1,3,5-triazin-2-yl)urea Alan Wood's Pesticides 2-iodo-N-[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)carbamoyl]benzene-1-sulfonamide Alan Wood's Pesticides 2-iodo-N-[[(4-methoxy-6-methyl-1,3,5-triazin-2-yl)amino]carbonyl]benzenesulfonamide Alan Wood's Pesticides Manual Xrefs Databases 2624 PPDB iofensulfuron Alan Wood's Pesticides View more database links Registry Number Type Source 1144097-22-2 CAS Registry Number Alan Wood's Pesticides Citations Types Sources 25129053 PubMed citation Europe PMC 26174603 PubMed citation Europe PMC Last Modified 14 March 2024