CHEBI:113087 - 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-methyl-4-(4-methylphenyl)-1,2,4-triazol-3-one

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ChEBI Name 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-methyl-4-(4-methylphenyl)-1,2,4-triazol-3-one
ChEBI ID CHEBI:113087
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C16H12ClF3N4O
Net Charge 0
Average Mass 368.741
Monoisotopic Mass 368.06517
InChI InChI=1S/C16H12ClF3N4O/c1-9-3-5-12(6-4-9)23-10(2)22-24(15(23)25)14-13(17)7-11(8-21-14)16(18,19)20/h3-8H,1-2H3
InChIKey YAJPGRLCOCGMDL-UHFFFAOYSA-N
SMILES CC1=CC=C(C=C1)N2C(=NN(C2=O)C3=C(C=C(C=N3)C(F)(F)F)Cl)C
ChEBI Ontology
Outgoing 2-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-5-methyl-4-(4-methylphenyl)-1,2,4-triazol-3-one (CHEBI:113087) is a triazoles (CHEBI:35727)
Manual Xref Database
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