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Details

Stereochemistry ABSOLUTE
Molecular Formula C27H27N5O2
Molecular Weight 453.5356
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of (7S)-4,5,6,7-Tetrahydro-7-[1-(1-oxo-2-propen-1-yl)-4-piperidinyl]-2-(4-phenoxyphenyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile

SMILES

C=CC(=O)N1CCC(CC1)[C@@H]2CCNC3=C(C#N)C(=NN23)C4=CC=C(OC5=CC=CC=C5)C=C4

InChI

InChIKey=QMQFPTAEMQLQKQ-DEOSSOPVSA-N
InChI=1S/C27H27N5O2/c1-2-25(33)31-16-13-19(14-17-31)24-12-15-29-27-23(18-28)26(30-32(24)27)20-8-10-22(11-9-20)34-21-6-4-3-5-7-21/h2-11,19,24,29H,1,12-17H2/t24-/m0/s1

HIDE SMILES / InChI

Molecular Formula C27H27N5O2
Molecular Weight 453.5356
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 Wed Apr 02 19:30:58 GMT 2025
Edited
by admin
on Wed Apr 02 19:30:58 GMT 2025
Record UNII
F4HR9U6TC5
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Pyrazolo[1,5-a]pyrimidine-3-carbonitrile, 4,5,6,7-tetrahydro-7-[1-(1-oxo-2-propen-1-yl)-4-piperidinyl]-2-(4-phenoxyphenyl)-, (7S)-
Preferred Name English
(7S)-4,5,6,7-Tetrahydro-7-[1-(1-oxo-2-propen-1-yl)-4-piperidinyl]-2-(4-phenoxyphenyl)pyrazolo[1,5-a]pyrimidine-3-carbonitrile
Systematic Name English
Code System Code Type Description
FDA UNII
F4HR9U6TC5
Created by admin on Wed Apr 02 19:30:58 GMT 2025 , Edited by admin on Wed Apr 02 19:30:58 GMT 2025
PRIMARY
PUBCHEM
170576176
Created by admin on Wed Apr 02 19:30:58 GMT 2025 , Edited by admin on Wed Apr 02 19:30:58 GMT 2025
PRIMARY
CAS
2432022-47-2
Created by admin on Wed Apr 02 19:30:58 GMT 2025 , Edited by admin on Wed Apr 02 19:30:58 GMT 2025
PRIMARY