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Details

Stereochemistry ACHIRAL
Molecular Formula C33H42ClN5O4S
Molecular Weight 640.236
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of APG-2449

SMILES

CC(C)OC1=C(NC2=NC=C(Cl)C(NC3=C(C=CC=C3)S(=O)(=O)C(C)C)=N2)C=C(C)C(=C1)C4=CCN(CC4)C5CCOCC5

InChI

InChIKey=YWPHBSHEGTZPNS-UHFFFAOYSA-N
InChI=1S/C33H42ClN5O4S/c1-21(2)43-30-19-26(24-10-14-39(15-11-24)25-12-16-42-17-13-25)23(5)18-29(30)37-33-35-20-27(34)32(38-33)36-28-8-6-7-9-31(28)44(40,41)22(3)4/h6-10,18-22,25H,11-17H2,1-5H3,(H2,35,36,37,38)

HIDE SMILES / InChI

Molecular Formula C33H42ClN5O4S
Molecular Weight 640.236
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 19:28:23 GMT 2023
Edited
by admin
on Sat Dec 16 19:28:23 GMT 2023
Record UNII
8L976E3N4N
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
APG-2449
Code English
2,4-Pyrimidinediamine, 5-chloro-N4-[2-[(1-methylethyl)sulfonyl]phenyl]-N2-[5-methyl-2-(1-methylethoxy)-4-[1,2,3,6-tetrahydro-1-(tetrahydro-2H-pyran-4-yl)-4-pyridinyl]phenyl]-
Systematic Name English
APG 2449 [WHO-DD]
Common Name English
APG2449
Code English
Code System Code Type Description
NCI_THESAURUS
C172193
Created by admin on Sat Dec 16 19:28:23 GMT 2023 , Edited by admin on Sat Dec 16 19:28:23 GMT 2023
PRIMARY
CAS
2196186-84-0
Created by admin on Sat Dec 16 19:28:23 GMT 2023 , Edited by admin on Sat Dec 16 19:28:23 GMT 2023
PRIMARY
FDA UNII
8L976E3N4N
Created by admin on Sat Dec 16 19:28:23 GMT 2023 , Edited by admin on Sat Dec 16 19:28:23 GMT 2023
PRIMARY
PUBCHEM
138678712
Created by admin on Sat Dec 16 19:28:23 GMT 2023 , Edited by admin on Sat Dec 16 19:28:23 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY