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Details

Stereochemistry ACHIRAL
Molecular Formula C42H44N8O
Molecular Weight 676.8518
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 7-CYCLOPENTYL-N,N-DIMETHYL-2-((5-(4-TRITYLPIPERAZIN-1-YL)PYRIDIN-2-YL)AMINO)-7H-PYRROLO(2,3-D)PYRIMIDINE-6-CARBOXAMIDE

SMILES

CN(C)C(=O)C1=CC2=C(N=C(NC3=CC=C(C=N3)N4CCN(CC4)C(C5=CC=CC=C5)(C6=CC=CC=C6)C7=CC=CC=C7)N=C2)N1C8CCCC8

InChI

InChIKey=IKSAVSJAJRREKD-UHFFFAOYSA-N
InChI=1S/C42H44N8O/c1-47(2)40(51)37-28-31-29-44-41(46-39(31)50(37)35-20-12-13-21-35)45-38-23-22-36(30-43-38)48-24-26-49(27-25-48)42(32-14-6-3-7-15-32,33-16-8-4-9-17-33)34-18-10-5-11-19-34/h3-11,14-19,22-23,28-30,35H,12-13,20-21,24-27H2,1-2H3,(H,43,44,45,46)

HIDE SMILES / InChI

Molecular Formula C42H44N8O
Molecular Weight 676.8518
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 11:33:15 GMT 2025
Edited
by admin
on Wed Apr 02 11:33:15 GMT 2025
Record UNII
HUE8RW73YS
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
7-CYCLOPENTYL-N,N-DIMETHYL-2-((5-(4-TRITYLPIPERAZIN-1-YL)PYRIDIN-2-YL)AMINO)-7H-PYRROLO(2,3-D)PYRIMIDINE-6-CARBOXAMIDE
Systematic Name English
7H-PYRROLO(2,3-D)PYRIMIDINE-6-CARBOXAMIDE, 7-CYCLOPENTYL-N,N-DIMETHYL-2-((5-(4-(TRIPHENYLMETHYL)-1-PIPERAZINYL)-2-PYRIDINYL)AMINO)-
Preferred Name English
Code System Code Type Description
CAS
2524428-16-6
Created by admin on Wed Apr 02 11:33:15 GMT 2025 , Edited by admin on Wed Apr 02 11:33:15 GMT 2025
PRIMARY
PUBCHEM
155256213
Created by admin on Wed Apr 02 11:33:15 GMT 2025 , Edited by admin on Wed Apr 02 11:33:15 GMT 2025
PRIMARY PUBCHEM
FDA UNII
HUE8RW73YS
Created by admin on Wed Apr 02 11:33:15 GMT 2025 , Edited by admin on Wed Apr 02 11:33:15 GMT 2025
PRIMARY