Methyl 4-(((3-(3-chlorophenyl)-5-thioxo-1H-1,2,4-triazol-4(5H)-yl)imino)methyl)benzoate

Catalog No. :
ACXNTB202
CAS No. :
478254-79-4
Molecular Formula :
C17H13ClN4O2S
Molecular Weight :
372.84

IUPAC Name:methyl (E)-4-(((3-(3-chlorophenyl)-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl)imino)methyl)benzoate

Methyl 4-(((3-(3-chlorophenyl)-5-thioxo-1H-1,2,4-triazol-4(5H)-yl)imino)methyl)benzoate structure diagram
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Product Information

Product NameMethyl 4-(((3-(3-chlorophenyl)-5-thioxo-1H-1,2,4-triazol-4(5H)-yl)imino)methyl)benzoate
IUPAC Namemethyl (E)-4-(((3-(3-chlorophenyl)-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl)imino)methyl)benzoate
MDL No.MFCD03933983
Molecular FormulaC17H13ClN4O2S
Molecular Weight372.84
SMILESO=C(OC)C1=CC=C(/C=N/N2C(C3=CC=CC(Cl)=C3)=NNC2=S)C=C1
InChI KeyGHCHJQUPNDMORP-VXLYETTFSA-N
SynonymME 4-(((3-(3-CHLOROPHENYL)-5-MERCAPTO-4H-1,2,4-TRIAZOL-4-YL)IMINO)ME)BENZOATE;SALOR-INT L229490-1EA;Benzoic acid, 4-[[[3-(3-chlorophenyl)-1,5-dihydro-5-thioxo-4H-1,2,4-triazol-4-yl]imino]methyl]-, methyl ester
CAS No.478254-79-4

Synthetic Route by SureRoute

1. ACXNTB202 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. ACKMUJ259 route compound structure diagram
    ACKMUJ2591571-08-0 In Stock
  2. Plus
  3. reactant_2 route compound structure diagram
    --
  4. Then
  5. ACXNTB202 route product structure diagram
    ACXNTB202478254-79-4
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2. ACXNTB202 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. ACQVKH312 route compound structure diagram
    ACQVKH3121184-54-9 In Stock
  2. Plus
  3. reactant_2 route compound structure diagram
    --
  4. Then
  5. ACXNTB202 route product structure diagram
    ACXNTB202478254-79-4
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