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Details

Stereochemistry ACHIRAL
Molecular Formula C16H18N6S
Molecular Weight 326.419
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 9-CYCLOPENTYL-6-((2-PYRIDINYLMETHYL)THIO)-9H-PURIN-2-AMINE

SMILES

NC1=NC2=C(N=CN2C3CCCC3)C(SCC4=CC=CC=N4)=N1

InChI

InChIKey=CHQGTTKOFFXHJB-UHFFFAOYSA-N
InChI=1S/C16H18N6S/c17-16-20-14-13(19-10-22(14)12-6-1-2-7-12)15(21-16)23-9-11-5-3-4-8-18-11/h3-5,8,10,12H,1-2,6-7,9H2,(H2,17,20,21)

HIDE SMILES / InChI

Molecular Formula C16H18N6S
Molecular Weight 326.419
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 Tue Apr 01 19:49:18 GMT 2025
Edited
by admin
on Tue Apr 01 19:49:18 GMT 2025
Record UNII
LFZ99C4WE7
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
9-CYCLOPENTYL-6-((2-PYRIDINYLMETHYL)THIO)-9H-PURIN-2-AMINE
Systematic Name English
NSC-59486
Preferred Name English
9H-PURINE, 2-AMINO-9-CYCLOPENTYL-6-((2-PYRIDYLMETHYL)THIO)-
Systematic Name English
NCI-59486
Code English
9H-PURIN-2-AMINE, 9-CYCLOPENTYL-6-((2-PYRIDINYLMETHYL)THIO)-
Systematic Name English
Code System Code Type Description
PUBCHEM
246464
Created by admin on Tue Apr 01 19:49:18 GMT 2025 , Edited by admin on Tue Apr 01 19:49:18 GMT 2025
PRIMARY
CAS
93014-76-7
Created by admin on Tue Apr 01 19:49:18 GMT 2025 , Edited by admin on Tue Apr 01 19:49:18 GMT 2025
PRIMARY
NSC
59486
Created by admin on Tue Apr 01 19:49:18 GMT 2025 , Edited by admin on Tue Apr 01 19:49:18 GMT 2025
PRIMARY
EPA CompTox
DTXSID70239244
Created by admin on Tue Apr 01 19:49:18 GMT 2025 , Edited by admin on Tue Apr 01 19:49:18 GMT 2025
PRIMARY
FDA UNII
LFZ99C4WE7
Created by admin on Tue Apr 01 19:49:18 GMT 2025 , Edited by admin on Tue Apr 01 19:49:18 GMT 2025
PRIMARY