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CHEBI:114686 - [4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]-(3-pyridinyl)methanone

ChEBI IDCHEBI:114686
ChEBI Name[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]-(3-pyridinyl)methanone
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FormulaC15H15N3O2S
Net Charge0
Average Mass301.371
Monoisotopic Mass301.08850
SMILESO=C(c1cccnc1)N1CCN(C(=O)c2cccs2)CC1
InChIInChI=1S/C15H15N3O2S/c19-14(12-3-1-5-16-11-12)17-6-8-18(9-7-17)15(20)13-4-2-10-21-13/h1-5,10-11H,6-9H2
InChIKeyOBJPERSDPVULEI-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)
[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]-(3-pyridinyl)methanone (CHEBI:114686) is a aromatic carboxylic acid (CHEBI:33859)
[4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]-(3-pyridinyl)methanone (CHEBI:114686) is a pyridinemonocarboxylic acid (CHEBI:26420)
Manual XrefsDatabases
LSM-26148LINCS