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Details

Stereochemistry ACHIRAL
Molecular Formula C19H23IN6O2S.2ClH
Molecular Weight 599.316
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ICAPAMESPIB DIHYDROCHLORIDE

SMILES

Cl.Cl.CC(C)(C)CNCCN1C(SC2=C(I)C=C3OCOC3=C2)=NC4=C1N=CN=C4N

InChI

InChIKey=XOTDTJJJOBBSFU-UHFFFAOYSA-N
InChI=1S/C19H23IN6O2S.2ClH/c1-19(2,3)8-22-4-5-26-17-15(16(21)23-9-24-17)25-18(26)29-14-7-13-12(6-11(14)20)27-10-28-13;;/h6-7,9,22H,4-5,8,10H2,1-3H3,(H2,21,23,24);2*1H

HIDE SMILES / InChI

Approval Year

Name Type Language
ICAPAMESPIB DIHYDROCHLORIDE
Common Name English
8-((6-Iodobenzo[d][1,3]dioxol-5-yl)thio)-9-(2-(neopentylamino)ethyl)-9H-purin-6-amine, dihydrochloride salt
Systematic Name English
9H-PURINE-9-ETHANAMINE, 6-AMINO-N-(2,2-DIMETHYLPROPYL)-8-((6-IODO-1,3-BENZODIOXOL-5-YL)THIO)-, HYDROCHLORIDE (1:2)
Systematic Name English
Classification Tree Code System Code
FDA ORPHAN DRUG 882822
Created by admin on Sat Dec 16 14:38:02 GMT 2023 , Edited by admin on Sat Dec 16 14:38:02 GMT 2023
Code System Code Type Description
CAS
2267287-26-1
Created by admin on Sat Dec 16 14:38:02 GMT 2023 , Edited by admin on Sat Dec 16 14:38:02 GMT 2023
PRIMARY
FDA UNII
Y0CQ2DGP7R
Created by admin on Sat Dec 16 14:38:02 GMT 2023 , Edited by admin on Sat Dec 16 14:38:02 GMT 2023
PRIMARY
PUBCHEM
154572872
Created by admin on Sat Dec 16 14:38:02 GMT 2023 , Edited by admin on Sat Dec 16 14:38:02 GMT 2023
PRIMARY