bupirimate (CHEBI:81952)

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ChEBI Name	bupirimate

ChEBI ID	CHEBI:81952

Definition	A member of the class of aminopyrimidines that is 2-ethylaminopyrimidine carrying methyl, butyl and dimethylaminosulfooxy substituents at posiitons 4, 5 and 6 respectively.

Stars	This entity has been manually annotated by the ChEBI Team.

Supplier Information	ChemicalBook:CB0310530, eMolecules:509602, ZINC000002006737

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Formula

C13H24N4O3S

Net Charge

Average Mass

316.42000

Monoisotopic Mass

316.15691

InChI

InChI=1S/C13H24N4O3S/c1-6-8-9-11-10(3)15-13(14-7-2)16-12(11)20-21(18,19)17(4)5/h6-9H2,1-5H3,(H,14,15,16)

InChIKey

DSKJPMWIHSOYEA-UHFFFAOYSA-N

SMILES

CCCCc1c(C)nc(NCC)nc1OS(=O)(=O)N(C)C

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):	antifungal agrochemical Any substance used in acriculture, horticulture, forestry, etc. for its fungicidal properties. androgen antagonist A compound which inhibits or antagonises the biosynthesis or actions of androgens. fungicide A substance used to destroy fungal pests. (via pyrimidine fungicide ) antifungal agent An antimicrobial agent that destroys fungi by suppressing their ability to grow or reproduce. (via pyrimidine antifungal agent )

Application(s):	antifungal agrochemical Any substance used in acriculture, horticulture, forestry, etc. for its fungicidal properties. androgen antagonist A compound which inhibits or antagonises the biosynthesis or actions of androgens. fungicide A substance used to destroy fungal pests. (via pyrimidine fungicide )

ChEBI Ontology
Outgoing	bupirimate (CHEBI:81952) has role androgen antagonist (CHEBI:35497) bupirimate (CHEBI:81952) has role antifungal agrochemical (CHEBI:86328) bupirimate (CHEBI:81952) is a aminopyrimidine (CHEBI:38338) bupirimate (CHEBI:81952) is a pyrimidine fungicide (CHEBI:87207) bupirimate (CHEBI:81952) is a secondary amino compound (CHEBI:50995) bupirimate (CHEBI:81952) is a sulfamate ester (CHEBI:48199)

IUPAC Name

5-butyl-2-(ethylamino)-6-methylpyrimidin-4-yl dimethylsulfamate

Synonyms	Sources
2-Äthylamino-5-butyl-4-yl-dimethylsulfamat	ChemIDplus
5-Butyl-2-(ethylamino)-6-methyl-4-pyrimidinyl dimethylsulfamate	ChemIDplus
5-Butyl-2-ethylamino-6-methylpyrimidin-4-yl dimethylsulphamate	ChemIDplus
Dimethylsulfamic acid 5-butyl-2-(ethylamino)-6-methyl-4-pyrimidinyl ester	ChemIDplus

Last Modified

29 July 2015