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
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Formula C12H18N4O6S
Net Charge 0
Average Mass 346.36000
Monoisotopic Mass 346.095
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.
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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 Waiting for 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