CHEBI:81941 - prosulfocarb

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ChEBI Name prosulfocarb
ChEBI ID CHEBI:81941
Definition A monothiocarbamic ester that is carbamothioic S-acid substituted by two propyl groups at the nitrogen atom and a benzyl group at the the sulfur atom.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information
Download Molfile XML SDF
Formula C14H21NOS
Net Charge 0
Average Mass 251.38800
Monoisotopic Mass 251.134
InChI InChI=1S/C14H21NOS/c1-3-10-15(11-4-2)14(16)17-12-13-8-6-5-7-9-13/h5-9H,3-4,10-12H2,1-2H3
InChIKey NQLVQOSNDJXLKG-UHFFFAOYSA-N
SMILES CCCN(CCC)C(=O)SCc1ccccc1
Roles Classification
Chemical Role(s): environmental contaminant
Any minor or unwanted substance introduced into the environment that can have undesired effects.
Biological Role(s): 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.
Application(s): herbicide
A substance used to destroy plant pests.
View more via ChEBI Ontology
ChEBI Ontology
Outgoing prosulfocarb (CHEBI:81941) has role environmental contaminant (CHEBI:78298)
prosulfocarb (CHEBI:81941) has role herbicide (CHEBI:24527)
prosulfocarb (CHEBI:81941) has role xenobiotic (CHEBI:35703)
prosulfocarb (CHEBI:81941) is a benzenes (CHEBI:22712)
prosulfocarb (CHEBI:81941) is a monothiocarbamic ester (CHEBI:38128)
IUPAC Name
S-benzyl dipropylcarbamothioate
Manual Xrefs Databases
C18760 KEGG COMPOUND
prosulfocarb Alan Wood's Pesticides
US2011152098 Patent
WO2011075562 Patent
View more database links
Registry Numbers Types Sources
4804364 Reaxys Registry Number Reaxys
52888-80-9 CAS Registry Number ChemIDplus
Citations Waiting for Citations Types Sources
23180504 PubMed citation Europe PMC
23423954 PubMed citation Europe PMC
Last Modified
14 November 2014