4-(2-Methylprop-2-en-1-yl)-5-(phenoxymethyl)-4H-1,2,4-triazole-3-thiol

Catalog No. :
ACDRUI259
CAS No. :
328556-78-1
Molecular Formula :
C13H15N3OS
Molecular Weight :
261.35

IUPAC Name:4-(2-methylallyl)-5-(phenoxymethyl)-4H-1,2,4-triazole-3-thiol

4-(2-Methylprop-2-en-1-yl)-5-(phenoxymethyl)-4H-1,2,4-triazole-3-thiol structure diagram
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Product Information

Product Name4-(2-Methylprop-2-en-1-yl)-5-(phenoxymethyl)-4H-1,2,4-triazole-3-thiol
IUPAC Name4-(2-methylallyl)-5-(phenoxymethyl)-4H-1,2,4-triazole-3-thiol
MDL No.MFCD00619000
Molecular FormulaC13H15N3OS
Molecular Weight261.35
SMILESSC1=NN=C(COC2=CC=CC=C2)N1CC(C)=C
InChI KeyTXNWUQMHKIYXJK-UHFFFAOYSA-N
Synonym4-(2-methylprop-2-enyl)-3-(phenoxymethyl)-1H-1,2,4-triazole-5-thione;4-(2-Methylprop-2-en-1-yl)-5-(phenoxymethyl)-4H-1,2,4-triazole-3-thiol;3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-(2-methyl-2-propen-1-yl)-5-(phenoxymethyl)-
CAS No.328556-78-1

Synthetic Route by SureRoute

1. ACDRUI259 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACDRUI259 route product structure diagram
    ACDRUI259328556-78-1
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2. ACDRUI259 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Plus
  3. ACPBYR859 route compound structure diagram
    ACPBYR859100-67-4
  4. Then
  5. ACDRUI259 route product structure diagram
    ACDRUI259328556-78-1
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