1,1-Dimethylethyl 4-[[1-[2-fluoro-4-(methylsulfonyl)phenyl]-1H-pyrazolo[3,4-d]pyrimidin-4-yl]thio]-1-piperidinecarboxylate

CAS Registry Number®

832715-08-9
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CAS Name

1,1-Dimethylethyl 4-[[1-[2-fluoro-4-(methylsulfonyl)phenyl]-1H-pyrazolo[3,4-d]pyrimidin-4-yl]thio]-1-piperidinecarboxylate

Molecular Formula

C22H26FN5O4S2

Molecular Mass

507.60

Cite this Page

1,1-Dimethylethyl 4-[[1-[2-fluoro-4-(methylsulfonyl)phenyl]-1H-pyrazolo[3,4-d]pyrimidin-4-yl]thio]-1-piperidinecarboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=832715-08-9 (retrieved 2024-09-19) (CAS RN: 832715-08-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C22H26FN5O4S2/c1-22(2,3)32-21(29)27-9-7-14(8-10-27)33-20-16-12-26-28(19(16)24-13-25-20)18-6-5-15(11-17(18)23)34(4,30)31/h5-6,11-14H,7-10H2,1-4H3

InChIKey

InChIKey=KRCCTTRJUJRZKA-UHFFFAOYSA-N

SMILES

S(C1=C2C(N(N=C2)C3=C(F)C=C(S(C)(=O)=O)C=C3)=NC=N1)C4CCN(C(OC(C)(C)C)=O)CC4

Canonical SMILES

O=C(OC(C)(C)C)N1CCC(SC2=NC=NC3=C2C=NN3C4=CC=C(C=C4F)S(=O)(=O)C)CC1

Other Names for this Substance

  • 1-Piperidinecarboxylic acid, 4-[[1-[2-fluoro-4-(methylsulfonyl)phenyl]-1H-pyrazolo[3,4-d]pyrimidin-4-yl]thio]-, 1,1-dimethylethyl ester
  • 1,1-Dimethylethyl 4-[[1-[2-fluoro-4-(methylsulfonyl)phenyl]-1H-pyrazolo[3,4-d]pyrimidin-4-yl]thio]-1-piperidinecarboxylate
  • 4-[[1-(2-Fluoro-4-methylsulfonylphenyl)-1H-pyrazolo[3,4-d]pyrimidin-4-yl]sulfanyl]piperidine-1-carboxylic acid tert-butyl ester