CHEBI:73163 - oryzalin

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ChEBI Name oryzalin ChEBI ID CHEBI:73163 Definition A sulfonamide that is benzenesulfonamide substituted at positions 3 and 5 by nitro groups and at position 4 by a dipropylamino group. Stars This entity has been manually annotated by the ChEBI Team. Submitter Johnny Lloyd Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Wikipedia License Read full article at Wikipedia Formula C12H18N4O6S Net Charge 0 Average Mass 346.36000 Monoisotopic Mass 346.09471 InChI InChI=1S/C12H18N4O6S/c1-3-5-14(6-4-2)12-10(15(17)18)7-9(23(13,21)22)8-11(12)16(19)20/h7-8H,3-6H2,1-2H3,(H2,13,21,22) InChIKey UNAHYJYOSSSJHH-UHFFFAOYSA-N SMILES CCCN(CCC)c1c(cc(cc1[N+]([O-])=O)S(N)(=O)=O)[N+]([O-])=O Roles Classification Chemical Role(s): Bronsted base A molecular entity capable of accepting a hydron from a donor (Bronsted acid). (via organic amino compound ) Biological Role(s): antimitotic Any compound that inhibits cell division (mitosis). Application(s): agrochemical An agrochemical is a substance that is used in agriculture or horticulture. herbicide A substance used to destroy plant pests. View more via ChEBI Ontology ChEBI Ontology Outgoing oryzalin (CHEBI:73163) has role agrochemical (CHEBI:33286) oryzalin (CHEBI:73163) has role antimitotic (CHEBI:64911) oryzalin (CHEBI:73163) has role herbicide (CHEBI:24527) oryzalin (CHEBI:73163) is a C-nitro compound (CHEBI:35716) oryzalin (CHEBI:73163) is a aromatic amine (CHEBI:33860) oryzalin (CHEBI:73163) is a sulfonamide (CHEBI:35358) oryzalin (CHEBI:73163) is a tertiary amino compound (CHEBI:50996) IUPAC Name 4-(dipropylamino)-3,5-dinitrobenzenesulfonamide Synonyms Sources 3,5-dinitro-N4,N4-dipropylsulfanilamide Alan Wood's Pesticides 3,5-Dinitro-N4,N4-dipropylsulphanilamide ChemIDplus 4-(dipropylamino)-3,5-dinitrobenzene-1-sulfonamide Alan Wood's Pesticides Manual Xrefs Databases 19044-88-3 Alan Wood's Pesticides 494 PPDB C18877 KEGG COMPOUND Oryzalin Wikipedia US2012108430 Patent View more database links Registry Numbers Types Sources 19044-88-3 CAS Registry Number KEGG COMPOUND 19044-88-3 CAS Registry Number NIST Chemistry WebBook 19044-88-3 CAS Registry Number ChemIDplus 2177305 Reaxys Registry Number Reaxys Citations Types Sources 20405146 PubMed citation Europe PMC 20870876 PubMed citation Europe PMC 21983568 PubMed citation Europe PMC 22771930 PubMed citation Europe PMC 23261650 PubMed citation Europe PMC Last Modified 22 December 2017