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11-[3-Chloro-5-(trifluoromethyl)pyridin-2-yl]-4-methyl-5-sulfanyl-8-thia-4,6,11-triazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),5-trien-3-one

Catalog No. :
ACHBUH844
CAS No. :
321430-49-3
Molecular Formula :
C16H12ClF3N4OS2
Molecular Weight :
432.88

IUPAC Name:7-(3-chloro-5-(trifluoromethyl)pyridin-2-yl)-3-methyl-2-thioxo-2,3,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(1H)-one

11-[3-Chloro-5-(trifluoromethyl)pyridin-2-yl]-4-methyl-5-sulfanyl-8-thia-4,6,11-triazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),5-trien-3-one structure diagram
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Product Information

Product Name11-[3-Chloro-5-(trifluoromethyl)pyridin-2-yl]-4-methyl-5-sulfanyl-8-thia-4,6,11-triazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),5-trien-3-one
IUPAC Name7-(3-chloro-5-(trifluoromethyl)pyridin-2-yl)-3-methyl-2-thioxo-2,3,5,6,7,8-hexahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(1H)-one
Molecular FormulaC16H12ClF3N4OS2
Molecular Weight432.88
SMILESO=C(N1C)C(C2=C(CN(C3=NC=C(C(F)(F)F)C=C3Cl)CC2)S4)=C4NC1=S
InChI KeyBXXUOQHTBMSYAB-UHFFFAOYSA-N
Synonym7-[3-CHLORO-5-(TRIFLUOROMETHYL)-2-PYRIDINYL]-3-METHYL-2-SULFANYL-5,6,7,8-TETRAHYDROPYRIDO[4',3':4,5]THIENO[2,3-D]PYRIMIDIN-4(3H)-ONE;11-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]-4-methyl-5-sulfanyl-8-thia-4,6,11-triazatricyclo[7.4.0.0^{2,7}]trideca-1(9),2(7),5-trien-3-one;Pyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4(1H)-one, 7-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-2,3,5,6,7,8-hexahydro-3-methyl-2-thioxo-
CAS No.321430-49-3

Safety Data

Pictogram
Harmful or irritant
Signal Word
Achtung
Hazard Statement(s)
H302-H315-H319-H335
Precautionary Statement(s)
P261-P264-P270-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P330-P362-P403+P233-P501

Synthetic Route by SureRoute

1. ACHBUH844 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. ACHBUH844 route product structure diagram
    ACHBUH844321430-49-3
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2. ACHBUH844 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
    --
  2. Then
  3. ACHBUH844 route product structure diagram
    ACHBUH844321430-49-3
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