CHEBI:51083 - M3

ChEBI IDCHEBI:51083
ChEBI NameM3
Stars
Last Modified25 November 2008
SubmitterInma Spiteri
DownloadsMolfile
FormulaC12H23N5S
Net Charge0
Average Mass269.418
Monoisotopic Mass269.16742
SMILESCSc1nc(NC(C)(C)C)nc(NC(C)(C)C)n1
InChIInChI=1S/C12H23N5S/c1-11(2,3)16-8-13-9(17-12(4,5)6)15-10(14-8)18-7/h1-7H3,(H2,13,14,15,16,17)
InChIKeyVONUTDHPPXOPTC-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
Application:
antifouling biocide  A compound that inhibits the growth of marine organisms.
ChEBI Ontology
Outgoing Relation(s)
M3 (CHEBI:51083) has parent hydride 1,3,5-triazine (CHEBI:30259)
M3 (CHEBI:51083) has role antifouling biocide (CHEBI:51076)
M3 (CHEBI:51083) has role metabolite (CHEBI:25212)
M3 (CHEBI:51083) is a diamine (CHEBI:23666)
IUPAC Name 
N,N'-di-tert-butyl-6-(methylsulfanyl)-1,3,5-triazine-2,4-diamine
Synonym  Source
N,N'-di-tert-butyl-6-methylthiol-s-triazine-2,4-diamineChEBI
Registry NumbersSources
Beilstein:614667Beilstein
CAS:5498-16-8Beilstein