5-({[3-(trifluoromethyl)anilino]carbonyl}amino)-2,1,3-benzoxadiazol-1-ium-1-olate

Catalog No. :
ACSTIG671
CAS No. :
655234-82-5
Molecular Formula :
C14H9F3N4O3
Molecular Weight :
338.24

IUPAC Name:5-(3-(3-(trifluoromethyl)phenyl)ureido)benzo[c][1,2,5]oxadiazole 1-oxide

5-({[3-(trifluoromethyl)anilino]carbonyl}amino)-2,1,3-benzoxadiazol-1-ium-1-olate structure diagram
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Product Information

Product Name5-({[3-(trifluoromethyl)anilino]carbonyl}amino)-2,1,3-benzoxadiazol-1-ium-1-olate
IUPAC Name5-(3-(3-(trifluoromethyl)phenyl)ureido)benzo[c][1,2,5]oxadiazole 1-oxide
Molecular FormulaC14H9F3N4O3
Molecular Weight338.24
SMILES[O-][N+]1=C2C(C=C(NC(NC3=CC=CC(C(F)(F)F)=C3)=O)C=C2)=NO1
InChI KeyWQISTHXFVMIAKD-UHFFFAOYSA-N
SynonymUrea, N-(1-oxido-2,1,3-benzoxadiazol-5-yl)-N'-[3-(trifluoromethyl)phenyl]-
CAS No.655234-82-5

Synthetic Route by SureRoute

1. ACSTIG671 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
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  2. Plus
  3. reactant_2 route compound structure diagram
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  4. Then
  5. ACSTIG671 route product structure diagram
    ACSTIG671655234-82-5
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2. ACSTIG671 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Plus
  3. reactant_2 route compound structure diagram
    --
  4. Then
  5. ACSTIG671 route product structure diagram
    ACSTIG671655234-82-5
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