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CHEBI:34846 - metribuzin

ChEBI IDCHEBI:34846
ChEBI Namemetribuzin
Stars
DefinitionA member of the class of 1,2,4-triazines that is 1,2,4-triazin-5(4H)-one substituted by an amino group at position 4, tert-butyl group at position 6 and a methylsulfanyl group at position 3.
Last Modified20 November 2014
DownloadsMolfile
FormulaC8H14N4OS
Net Charge0
Average Mass214.294
Monoisotopic Mass214.08883
SMILESCSc1nnc(C(C)(C)C)c(=O)n1N
InChIInChI=1S/C8H14N4OS/c1-8(2,3)5-6(13)12(9)7(14-4)11-10-5/h9H2,1-4H3
InChIKeyFOXFZRUHNHCZPX-UHFFFAOYSA-N
Wikipedia
Roles Classification
Chemical Role:
environmental contaminant  Any minor or unwanted substance introduced into the environment that can have undesired effects.
Biological Role:
xenobiotic  A xenobiotic (Greek, xenos "foreign"; bios "life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means.
Applications:
agrochemical  An agrochemical is a substance that is used in agriculture or horticulture.
herbicide  A substance used to destroy plant pests.
ChEBI Ontology
Outgoing Relation(s)
metribuzin (CHEBI:34846) has role agrochemical (CHEBI:33286)
metribuzin (CHEBI:34846) has role environmental contaminant (CHEBI:78298)
metribuzin (CHEBI:34846) has role herbicide (CHEBI:24527)
metribuzin (CHEBI:34846) has role xenobiotic (CHEBI:35703)
metribuzin (CHEBI:34846) is a 1,2,4-triazines (CHEBI:39410)
metribuzin (CHEBI:34846) is a cyclic ketone (CHEBI:3992)
metribuzin (CHEBI:34846) is a organic sulfide (CHEBI:16385)
IUPAC Name 
4-amino-6-tert-butyl-3-(methylsulfanyl)-1,2,4-triazin-5(4H)-one
Synonym  Source
4-amino-6-tert-butyl-4,5-dihydro-3-methylthio-1,2,4-triazin-5-oneChEBI
Manual XrefsDatabases
469PPDB
C14332KEGG COMPOUND
metribuzinAlan Wood's Pesticides
MetribuzinWikipedia
Registry NumbersSources
Reaxys:746650Reaxys
CAS:21087-64-9NIST Chemistry WebBook
CAS:21087-64-9KEGG COMPOUND
CAS:21087-64-9ChemIDplus
Citations