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CHEBI:593538 - N,N'-bis(pyridin-3-ylmethyl)pyrimidine-4,6-dicarboxamide

ChEBI IDCHEBI:593538
ChEBI NameN,N'-bis(pyridin-3-ylmethyl)pyrimidine-4,6-dicarboxamide
Stars
ASCII NameN,N'-bis(pyridin-3-ylmethyl)pyrimidine-4,6-dicarboxamide
DefinitionA pyrimidinecarboxamide having the amido groups at the 4- and 6-positions and pyridin-3-ylmethyl as the amide N-substituents.
Secondary ChEBI IDsCHEBI:44802, CHEBI:572327
Last Modified21 November 2019
DownloadsMolfile
FormulaC18H16N6O2
Net Charge0
Average Mass348.366
Monoisotopic Mass348.13347
SMILESO=C(NCc1cccnc1)c1cc(C(=O)NCc2cccnc2)ncn1
InChIInChI=1S/C18H16N6O2/c25-17(21-10-13-3-1-5-19-8-13)15-7-16(24-12-23-15)18(26)22-11-14-4-2-6-20-9-14/h1-9,12H,10-11H2,(H,21,25)(H,22,26)
InChIKeyNHPBWKYFMTXWAA-UHFFFAOYSA-N
ChEBI Ontology
Outgoing Relation(s)
N,N'-bis(pyridin-3-ylmethyl)pyrimidine-4,6-dicarboxamide (CHEBI:593538) is a pyridines (CHEBI:26421)
N,N'-bis(pyridin-3-ylmethyl)pyrimidine-4,6-dicarboxamide (CHEBI:593538) is a pyrimidinecarboxamide (CHEBI:48438)
IUPAC Name 
N,N'-bis(pyridin-3-ylmethyl)pyrimidine-4,6-dicarboxamide
Synonyms  Source
N4,N6-bis[(pyridin-3-yl)methyl]pyrimidine-4,6-dicarboxamideIUPAC
pyrimidine-4,6-dicarboxylic acid bis-[(pyridin-3-ylmethyl)-amide]DrugBank
Manual XrefsDatabases
PB5PDBeChem
DB04761DrugBank