1,1-Dimethylethyl (3S)-3-(4-amino-3-iodo-1H-pyrazolo[3,4-d]pyrimidin-1-yl)-1-piperidinecarboxylate

CAS Registry Number®

461702-66-9
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CAS Name

1,1-Dimethylethyl (3S)-3-(4-amino-3-iodo-1H-pyrazolo[3,4-d]pyrimidin-1-yl)-1-piperidinecarboxylate

Molecular Formula

C15H21IN6O2

Molecular Mass

444.27

Cite this Page

1,1-Dimethylethyl (3S)-3-(4-amino-3-iodo-1H-pyrazolo[3,4-d]pyrimidin-1-yl)-1-piperidinecarboxylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=461702-66-9 (retrieved 2024-09-09) (CAS RN: 461702-66-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C15H21IN6O2/c1-15(2,3)24-14(23)21-6-4-5-9(7-21)22-13-10(11(16)20-22)12(17)18-8-19-13/h8-9H,4-7H2,1-3H3,(H2,17,18,19)/t9-/m0/s1

InChIKey

InChIKey=YQXAEBHPCJZKKX-VIFPVBQESA-N

SMILES

IC=1C=2C(N(N1)[C@@H]3CN(C(OC(C)(C)C)=O)CCC3)=NC=NC2N

Canonical SMILES

O=C(OC(C)(C)C)N1CCCC(N2N=C(I)C=3C(=NC=NC32)N)C1

Other Names for this Substance

  • 1-Piperidinecarboxylic acid, 3-(4-amino-3-iodo-1H-pyrazolo[3,4-d]pyrimidin-1-yl)-, 1,1-dimethylethyl ester, (3S)-
  • 1,1-Dimethylethyl (3S)-3-(4-amino-3-iodo-1H-pyrazolo[3,4-d]pyrimidin-1-yl)-1-piperidinecarboxylate
  • (S)-tert-Butyl 3-(4-amino-3-iodo-1H-pyrazolo[3,4-d]pyrimidin-1-yl)-1-piperidinecarboxylate