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Chemical Structure| 459434-39-0 Chemical Structure| 459434-39-0

Structure of 459434-39-0

Chemical Structure| 459434-39-0

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Product Details of [ 459434-39-0 ]

CAS No. :459434-39-0
Formula : C9H12N2O2S
M.W : 212.27
SMILES Code : O=S(C1=CC=CC(N)=C1)(NC2CC2)=O
MDL No. :MFCD07022080

Safety of [ 459434-39-0 ]

GHS Pictogram:
Signal Word:Warning
Hazard Statements:H302-H315-H319-H335
Precautionary Statements:P305+P351+P338-P411+P235-P280

Application In Synthesis of [ 459434-39-0 ]

* All experimental methods are cited from the reference, please refer to the original source for details. We do not guarantee the accuracy of the content in the reference.

  • Downstream synthetic route of [ 459434-39-0 ]

[ 459434-39-0 ] Synthesis Path-Downstream   1~1

  • 1
  • [ 459434-39-0 ]
  • [ 848398-41-4 ]
  • 2-chloro-N4-(3-[N-cyclopropylsulfamoyl]phenyl)-5,7-dihydrofuro[3,4-d]pyrimidine-4-amine [ No CAS ]
YieldReaction ConditionsOperation in experiment
90% With N-ethyl-N,N-diisopropylamine; In isopropyl alcohol; at 100℃; for 18h; This was prepared from MA2-096 (0.096 g) and RJl-042 (0.212 g) using procedure B (reaction time, 18 h, reaction temperature 100 C) and isolated in the same way as MA2-030 to give the title compound MA3-002-3 as a white solid (0.165 g, 90%). Mp: 208 C (dec). NMR (400 MHz, DMSO-ifc): delta 9.86 (s, 1H, disappeared on D20 shake), 8.10 (s, 1H), 8.00 (d with unresolved fine coupling, / = 8.2, Hz, 1H), 7.96 (d, / = 2.3 Hz, 1H, disappeared on D20 shake), 7.62 (t, / = 8.0 Hz, 1H), 7.52 (d, / = 8.0 Hz, 1H), 5.02 (s, 2H), 4.87 (s, 2H), 2.22-2.12 (m, 1H), 0.56-0.48 (m, 2H), 0.47-0.38 (m, 2H). HPLC-MS (ESI+): m/z 757.1 [20%, (2M37C1+Na)+], 755.1 [30%, (2M35C1+Na)+], 369.1 [40%, (M37C1+H)+], 367.1 [100%, (M35C1 +]. Procedure B A mixture of substituted 2,4-dichloropyrimidine (1.0 equiv.), and substituted aniline (1.0-1.05 equiv.), and DIPEA (1.2 equiv.) in isopropanol (0.1 M) was stirred and heated at reflux. The reaction time, work-up, and product isolation procedure are described below.
 

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