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Details

Stereochemistry ABSOLUTE
Molecular Formula C23H32N6OSi
Molecular Weight 436.6253
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of β-Cyclopentyl-4-[7-[[2-(trimethylsilyl)ethoxy]methyl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-1H-pyrazole-1-propanenitrile, (βS)-

SMILES

C[Si](C)(C)CCOCN1C=CC2=C(N=CN=C12)C3=CN(N=C3)[C@@H](CC#N)C4CCCC4

InChI

InChIKey=QHQSWYIJDFMBNE-NRFANRHFSA-N
InChI=1S/C23H32N6OSi/c1-31(2,3)13-12-30-17-28-11-9-20-22(25-16-26-23(20)28)19-14-27-29(15-19)21(8-10-24)18-6-4-5-7-18/h9,11,14-16,18,21H,4-8,12-13,17H2,1-3H3/t21-/m0/s1

HIDE SMILES / InChI

Molecular Formula C23H32N6OSi
Molecular Weight 436.6253
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 20:20:17 GMT 2023
Edited
by admin
on Sat Dec 16 20:20:17 GMT 2023
Record UNII
7XML97PTT2
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
β-Cyclopentyl-4-[7-[[2-(trimethylsilyl)ethoxy]methyl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-1H-pyrazole-1-propanenitrile, (βS)-
Systematic Name English
1H-Pyrazole-1-propanenitrile β-cyclopentyl-4-[7-[[2-(trimethylsilyl)ethoxy]methyl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-, (βS)-
Systematic Name English
1H-Pyrazole-1-propanenitrile, β-cyclopentyl-4-[7-[[2-(trimethylsilyl)ethoxy]methyl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-, (βS)-
Systematic Name English
(βS)-β-Cyclopentyl-4-[7-[[2-(trimethylsilyl)ethoxy]methyl]-7H-pyrrolo[2,3-d]pyrimidin-4-yl]-1H-pyrazole-1-propanenitrile
Systematic Name English
Code System Code Type Description
CAS
941685-41-2
Created by admin on Sat Dec 16 20:20:17 GMT 2023 , Edited by admin on Sat Dec 16 20:20:17 GMT 2023
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FDA UNII
7XML97PTT2
Created by admin on Sat Dec 16 20:20:17 GMT 2023 , Edited by admin on Sat Dec 16 20:20:17 GMT 2023
PRIMARY
PUBCHEM
59420161
Created by admin on Sat Dec 16 20:20:17 GMT 2023 , Edited by admin on Sat Dec 16 20:20:17 GMT 2023
PRIMARY