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CHEBI:141519 - trifludimoxazin

ChEBI IDCHEBI:141519
ChEBI Nametrifludimoxazin
Stars
DefinitionA member of the class of 1,3,5-triazinanes that is 6-sulfanylidene-1,3,5-triazinane-2,4-dione in which the hydrogens attached to the nitrogens adjacent to the thioxo group have been replace by methyl groups and in which the hydrogen attached to the remaining nitrogen has replaced by a 2,2,7-trifluoro-3-oxo-4-(prop-2-yn-1-yl)-3,4-dihydro-1,4-benzoxazin-6-yl group. A protoporphyrinogen oxidase inhibitor, it is used as a herbicide.
Last Modified29 July 2018
SubmitterGareth Owen
DownloadsMolfile
FormulaC16H11F3N4O4S
Net Charge0
Average Mass412.349
Monoisotopic Mass412.04531
SMILESC#CCN1C(=O)C(F)(F)Oc2cc(F)c(-n3c(=O)n(C)c(=S)n(C)c3=O)cc21
InChIInChI=1S/C16H11F3N4O4S/c1-4-5-22-10-7-9(8(17)6-11(10)27-16(18,19)12(22)24)23-13(25)20(2)15(28)21(3)14(23)26/h1,6-7H,5H2,2-3H3
InChIKeyAZHZOGYUMMIAOF-UHFFFAOYSA-N
Roles Classification
Biological Role:
EC 1.3.3.4 (protoporphyrinogen oxidase) inhibitor  An EC 1.3.3.* (oxidoreductase acting on donor CH-CH group with oxygen as acceptor) inhibitor that interferes with the action of protoporphyrinogen oxidase (EC 1.3.3.4).
Applications:
herbicide  A substance used to destroy plant pests.
agrochemical  An agrochemical is a substance that is used in agriculture or horticulture.
ChEBI Ontology
Outgoing Relation(s)
trifludimoxazin (CHEBI:141519) has role agrochemical (CHEBI:33286)
trifludimoxazin (CHEBI:141519) has role EC 1.3.3.4 (protoporphyrinogen oxidase) inhibitor (CHEBI:73192)
trifludimoxazin (CHEBI:141519) has role herbicide (CHEBI:24527)
trifludimoxazin (CHEBI:141519) is a 1,3,5-triazinanes (CHEBI:38779)
trifludimoxazin (CHEBI:141519) is a benzoxazine (CHEBI:46969)
trifludimoxazin (CHEBI:141519) is a organofluorine compound (CHEBI:37143)
IUPAC Names 
1,5-dimethyl-6-thioxo-3-[2,2,7-trifluoro-3-oxo-4-(prop-2-yn-1-yl)-3,4-dihydro-2H-1,4-benzoxazin-6-yl]-1,3,5-triazinane-2,4-dione
1,5-dimethyl-6-sulfanylidene-3-[2,2,7-trifluoro-3-oxo-4-(prop-2-yn-1-yl)-3,4-dihydro-2H-1,4-benzoxazin-6-yl]-1,3,5-triazinane-2,4-dione
Synonyms  Source
dihydro-1,5-dimethyl-6-thioxo-3-[2,2,7-trifluoro-3,4-dihydro-3-oxo-4-(2-propyn-1-yl)-2H-1,4-benzoxazin-6-yl]-1,3,5-triazine-2,4(1H,3H)-dioneAlan Wood's Pesticides
1,5-dimethyl-6-thioxo-3-(2,2,7-trifluoro-3,4-dihydro-3-oxo-4-prop-2-ynyl-2H-1,4-benzoxazin-6-yl)-1,3,5-triazinane-2,4-dioneAlan Wood's Pesticides
trifludimoxazineChEBI
Brand Name  Source
TirexorChEBI
Manual XrefsDatabases
trifludimoxazinAlan Wood's Pesticides
Registry NumbersSources
CAS:1258836-72-4Alan Wood's Pesticides
CAS:1258836-72-4ChemIDplus