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Details

Stereochemistry ACHIRAL
Molecular Formula C17H22N8O
Molecular Weight 354.4096
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of VS-5584

SMILES

CC(C)N1C(C)=NC2=C(N=C(N=C12)N3CCOCC3)C4=CN=C(N)N=C4

InChI

InChIKey=QYBGBLQCOOISAR-UHFFFAOYSA-N
InChI=1S/C17H22N8O/c1-10(2)25-11(3)21-14-13(12-8-19-16(18)20-9-12)22-17(23-15(14)25)24-4-6-26-7-5-24/h8-10H,4-7H2,1-3H3,(H2,18,19,20)

HIDE SMILES / InChI

Molecular Formula C17H22N8O
Molecular Weight 354.4096
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 Sat Dec 16 11:04:58 UTC 2023
Edited
by admin
on Sat Dec 16 11:04:58 UTC 2023
Record UNII
W71J4X250V
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
VS-5584
Common Name English
5-(8-METHYL-9-(1-METHYLETHYL)-2-(4-MORPHOLINYL)-9H-PURIN-6YL)-2-PYRIMIDINAMINE
Systematic Name English
VS 5584 [WHO-DD]
Common Name English
2-PYRIMIDINAMINE, 5-(8-METHYL-9-(1-METHYLETHYL)-2-(4-MORPHOLINYL)-9H-PURIN-6-YL)-
Systematic Name English
Classification Tree Code System Code
FDA ORPHAN DRUG 463614
Created by admin on Sat Dec 16 11:04:58 UTC 2023 , Edited by admin on Sat Dec 16 11:04:58 UTC 2023
Code System Code Type Description
PUBCHEM
46912230
Created by admin on Sat Dec 16 11:04:58 UTC 2023 , Edited by admin on Sat Dec 16 11:04:58 UTC 2023
PRIMARY
DRUG BANK
DB12986
Created by admin on Sat Dec 16 11:04:58 UTC 2023 , Edited by admin on Sat Dec 16 11:04:58 UTC 2023
PRIMARY
ChEMBL
CHEMBL1079593
Created by admin on Sat Dec 16 11:04:58 UTC 2023 , Edited by admin on Sat Dec 16 11:04:58 UTC 2023
PRIMARY
FDA UNII
W71J4X250V
Created by admin on Sat Dec 16 11:04:58 UTC 2023 , Edited by admin on Sat Dec 16 11:04:58 UTC 2023
PRIMARY
NCI_THESAURUS
C112497
Created by admin on Sat Dec 16 11:04:58 UTC 2023 , Edited by admin on Sat Dec 16 11:04:58 UTC 2023
PRIMARY
EPA CompTox
DTXSID10677328
Created by admin on Sat Dec 16 11:04:58 UTC 2023 , Edited by admin on Sat Dec 16 11:04:58 UTC 2023
PRIMARY
SMS_ID
100000177724
Created by admin on Sat Dec 16 11:04:58 UTC 2023 , Edited by admin on Sat Dec 16 11:04:58 UTC 2023
PRIMARY
EVMPD
SUB193263
Created by admin on Sat Dec 16 11:04:58 UTC 2023 , Edited by admin on Sat Dec 16 11:04:58 UTC 2023
PRIMARY
CAS
1246560-33-7
Created by admin on Sat Dec 16 11:04:58 UTC 2023 , Edited by admin on Sat Dec 16 11:04:58 UTC 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY