CHEBI:119936 - 2-fluorobenzoic acid [[amino-(5,7-dimethyl-3-pyrazolo[1,5-a]pyrimidinyl)methylidene]amino] ester

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ChEBI Name 2-fluorobenzoic acid [[amino-(5,7-dimethyl-3-pyrazolo[1,5-a]pyrimidinyl)methylidene]amino] ester
ChEBI ID CHEBI:119936
Stars This entity has been manually annotated by a third party.
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Formula C16H14FN5O2
Net Charge 0
Average Mass 327.314
Monoisotopic Mass 327.11315
InChI InChI=1S/C16H14FN5O2/c1-9-7-10(2)22-15(20-9)12(8-19-22)14(18)21-24-16(23)11-5-3-4-6-13(11)17/h3-8H,1-2H3,(H2,18,21)
InChIKey MEYBRRDRZNYOBF-UHFFFAOYSA-N
SMILES CC1=CC(=NC2=C(C=NN12)C(=NOC(=O)C3=CC=CC=C3F)N)C
ChEBI Ontology
Outgoing 2-fluorobenzoic acid [[amino-(5,7-dimethyl-3-pyrazolo[1,5-a]pyrimidinyl)methylidene]amino] ester (CHEBI:119936) is a carbonyl compound (CHEBI:36586)
2-fluorobenzoic acid [[amino-(5,7-dimethyl-3-pyrazolo[1,5-a]pyrimidinyl)methylidene]amino] ester (CHEBI:119936) is a organohalogen compound (CHEBI:17792)
Manual Xref Database
LSM-31379 LINCS
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