CHEBI:105025 - 5-[(4-chlorophenyl)methylamino]-6-methyl-2H-1,2,4-triazin-3-one

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ChEBI Name 5-[(4-chlorophenyl)methylamino]-6-methyl-2H-1,2,4-triazin-3-one
ChEBI ID CHEBI:105025
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C11H11ClN4O
Net Charge 0
Average Mass 250.685
Monoisotopic Mass 250.06214
InChI InChI=1S/C11H11ClN4O/c1-7-10(14-11(17)16-15-7)13-6-8-2-4-9(12)5-3-8/h2-5H,6H2,1H3,(H2,13,14,16,17)
InChIKey LXHRVYBKTPIEMY-UHFFFAOYSA-N
SMILES CC1=NNC(=O)N=C1NCC2=CC=C(C=C2)Cl
Roles Classification
Chemical Role(s): Bronsted base
A molecular entity capable of accepting a hydron from a donor (Bronsted acid).
(via organic amino compound )
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ChEBI Ontology
Outgoing 5-[(4-chlorophenyl)methylamino]-6-methyl-2H-1,2,4-triazin-3-one (CHEBI:105025) is a aralkylamine (CHEBI:18000)
Manual Xref Database
LSM-16388 LINCS
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