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CHEBI:121490 - [3-(2-furanyl)-5-(thiophen-2-ylmethylamino)-1,2,4-triazol-1-yl]-(3-pyridinyl)methanone

ChEBI IDCHEBI:121490
ChEBI Name[3-(2-furanyl)-5-(thiophen-2-ylmethylamino)-1,2,4-triazol-1-yl]-(3-pyridinyl)methanone
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DownloadsMolfile
FormulaC17H13N5O2S
Net Charge0
Average Mass351.391
Monoisotopic Mass351.07900
SMILESO=C(c1cccnc1)n1nc(-c2ccco2)nc1NCc1cccs1
InChIInChI=1S/C17H13N5O2S/c23-16(12-4-1-7-18-10-12)22-17(19-11-13-5-3-9-25-13)20-15(21-22)14-6-2-8-24-14/h1-10H,11H2,(H,19,20,21)
InChIKeyTXWBMUBXCIYFDD-UHFFFAOYSA-N
Roles Classification
Chemical Role:
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
[3-(2-furanyl)-5-(thiophen-2-ylmethylamino)-1,2,4-triazol-1-yl]-(3-pyridinyl)methanone (CHEBI:121490) is a aromatic carboxylic acid (CHEBI:33859)
[3-(2-furanyl)-5-(thiophen-2-ylmethylamino)-1,2,4-triazol-1-yl]-(3-pyridinyl)methanone (CHEBI:121490) is a pyridinemonocarboxylic acid (CHEBI:26420)
Manual XrefsDatabases
LSM-32933LINCS