CHEBI:120470 - (3-amino-1,2,4-triazol-4-yl)-(2,5-dimethylphenyl)methanone

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ChEBI Name (3-amino-1,2,4-triazol-4-yl)-(2,5-dimethylphenyl)methanone
ChEBI ID CHEBI:120470
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C11H12N4O
Net Charge 0
Average Mass 216.240
Monoisotopic Mass 216.10111
InChI InChI=1S/C11H12N4O/c1-7-3-4-8(2)9(5-7)10(16)15-6-13-14-11(15)12/h3-6H,1-2H3,(H2,12,14)
InChIKey YZMUEWQJIGOEBX-UHFFFAOYSA-N
SMILES CC1=CC(=C(C=C1)C)C(=O)N2C=NN=C2N
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
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ChEBI Ontology
Outgoing (3-amino-1,2,4-triazol-4-yl)-(2,5-dimethylphenyl)methanone (CHEBI:120470) is a benzoic acids (CHEBI:22723)
Manual Xref Database
LSM-31913 LINCS
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