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Details

Stereochemistry ACHIRAL
Molecular Formula C28H20N8
Molecular Weight 468.512
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of LUT-012

SMILES

CC1=C(NC2=C(C=CC=N2)C3=C4NC=NC4=NC=N3)C5=C(C=C1)C(NC6=CC(=CC=C6)C#C)=NC=C5

InChI

InChIKey=NNPAUMAACJPWOQ-UHFFFAOYSA-N
InChI=1S/C28H20N8/c1-3-18-6-4-7-19(14-18)35-26-21-10-9-17(2)23(20(21)11-13-30-26)36-27-22(8-5-12-29-27)24-25-28(33-15-31-24)34-16-32-25/h1,4-16H,2H3,(H,29,36)(H,30,35)(H,31,32,33,34)

HIDE SMILES / InChI

Molecular Formula C28H20N8
Molecular Weight 468.512
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 18:09:44 GMT 2023
Edited
by admin
on Sat Dec 16 18:09:44 GMT 2023
Record UNII
8BZ6PM7DDW
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
LUT-012
Code English
1,5-Isoquinolinediamine, N1-(3-ethynylphenyl)-6-methyl-N5-[3-(9H-purin-6-yl)-2-pyridinyl]-
Systematic Name English
LUT012
Code English
Code System Code Type Description
PUBCHEM
156097066
Created by admin on Sat Dec 16 18:09:44 GMT 2023 , Edited by admin on Sat Dec 16 18:09:44 GMT 2023
PRIMARY
FDA UNII
8BZ6PM7DDW
Created by admin on Sat Dec 16 18:09:44 GMT 2023 , Edited by admin on Sat Dec 16 18:09:44 GMT 2023
PRIMARY
CAS
2274819-44-0
Created by admin on Sat Dec 16 18:09:44 GMT 2023 , Edited by admin on Sat Dec 16 18:09:44 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY