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NCATSSM5637

Catalog No. :
ACDQKH745
CAS No. :
2170615-16-2
Molecular Formula :
C31H30Cl2N4O2S
Molecular Weight :
593.58

IUPAC Name:1-(5-chloro-2-ethylphenyl)-3-(4-(4-chlorophenyl)thiazol-2-yl)-6-(2-methylprop-1-en-1-yl)-5-(piperazine-1-carbonyl)pyridin-2(1H)-one

NCATSSM5637 structure diagram
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Product Information

Product NameNCATSSM5637
IUPAC Name1-(5-chloro-2-ethylphenyl)-3-(4-(4-chlorophenyl)thiazol-2-yl)-6-(2-methylprop-1-en-1-yl)-5-(piperazine-1-carbonyl)pyridin-2(1H)-one
Molecular FormulaC31H30Cl2N4O2S
Molecular Weight593.58
SMILESCCC1=CC=C(Cl)C=C1N1C(C=C(C)C)=C(C(=O)N2CCNCC2)C=C(C2=NC(C3=CC=C(Cl)C=C3)=CS2)C1=O
InChI KeyJNGMCUDKLGCROW-UHFFFAOYSA-N
Synonym1-(5-Chloro-2-ethylphenyl)-3-[4-(4-chlorophenyl)-2-thiazolyl]-6-(2-methyl-1-propen-1-yl)-5-(1-piperazinylcarbonyl)-2(1H)-pyridinone;NCATS-SM5637
CAS No.2170615-16-2

Synthetic Route by SureRoute

1. ACDQKH745 Molecular Building Block Synthetic Route

Source: SureRouteAuthor: aifchem

  1. reactant_1 route compound structure diagram
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  2. Then
  3. ACDQKH745 route product structure diagram
    ACDQKH7452170615-16-2
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2. ACDQKH745 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. ACDQKH745 route product structure diagram
    ACDQKH7452170615-16-2
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