U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C18H21IN6O2S
Molecular Weight 509.37
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ZELAVESPIB I-124

SMILES

CC(C)NCCCN1C(SC2=C([124I])C=C3OCOC3=C2)=NC4=C1N=CN=C4N

InChI

InChIKey=SUPVGFZUWFMATN-JVYRTNJDSA-N
InChI=1S/C18H21IN6O2S/c1-10(2)21-4-3-5-25-17-15(16(20)22-8-23-17)24-18(25)28-14-7-13-12(6-11(14)19)26-9-27-13/h6-8,10,21H,3-5,9H2,1-2H3,(H2,20,22,23)/i19-3

HIDE SMILES / InChI

Approval Year

Name Type Language
(124I)PU-H71
Preferred Name English
ZELAVESPIB I-124
Common Name English
PU-H71 I-124
Code English
6-AMINO-8-((6-(IODO-124I)-1,3-BENZODIOXOL-5-YL)THIO)-N-(1-METHYLETHYL)-9H-PURINE-9-PROPANAMINE
Systematic Name English
9H-PURINE-9-PROPANAMINE, 6-AMINO-8-((6-(IODO-124I)-1,3-BENZODIOXOL-5-YL)THIO)-N-(1-METHYLETHYL)-
Systematic Name English
(124I)PUH-71
Code English
Code System Code Type Description
CAS
1352930-11-0
Created by admin on Mon Mar 31 19:55:33 GMT 2025 , Edited by admin on Mon Mar 31 19:55:33 GMT 2025
PRIMARY
PUBCHEM
56643475
Created by admin on Mon Mar 31 19:55:33 GMT 2025 , Edited by admin on Mon Mar 31 19:55:33 GMT 2025
PRIMARY
FDA UNII
35RT31667F
Created by admin on Mon Mar 31 19:55:33 GMT 2025 , Edited by admin on Mon Mar 31 19:55:33 GMT 2025
PRIMARY