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CHEBI:47124 - N7-butyl-N2-(5-chloro-2-methylphenyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-2,7-diamine

ChEBI IDCHEBI:47124
ChEBI NameN7-butyl-N2-(5-chloro-2-methylphenyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-2,7-diamine
Stars
ASCII NameN(7)-butyl-N(2)-(5-chloro-2-methylphenyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-2,7-diamine
Last Modified24 October 2014
DownloadsMolfile
FormulaC17H21ClN6
Net Charge0
Average Mass344.850
Monoisotopic Mass344.15162
SMILES[H]c1c([H])c(C([H])([H])[H])c(N([H])c2nc3nc(C([H])([H])[H])c([H])c(N([H])C([H])([H])C([H])([H])C([H])([H])C([H])([H])[H])n3n2)c([H])c1Cl
InChIInChI=1S/C17H21ClN6/c1-4-5-8-19-15-9-12(3)20-17-22-16(23-24(15)17)21-14-10-13(18)7-6-11(14)2/h6-7,9-10,19H,4-5,8H2,1-3H3,(H,21,23)
InChIKeyZTYBIJUAAWLJNU-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
N7-butyl-N2-(5-chloro-2-methylphenyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-2,7-diamine (CHEBI:47124) is a monochlorobenzenes (CHEBI:83403)
N7-butyl-N2-(5-chloro-2-methylphenyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-2,7-diamine (CHEBI:47124) is a triazolopyrimidines (CHEBI:48435)
Synonyms  Source
N~7~-butyl-N~2~-(5-chloro-2-methylphenyl)-5-methyl[1,2,4]triazolo[1,5-a]pyrimidine-2,7-diaminePDBeChem
N7-BUTYL-N2-(5-CHLORO-2-METHYLPHENYL)-5-METHYL[1,2,4]TRIAZOLO[1,5-A]PYRIMIDINE-2,7-DIAMINEPDBeChem
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