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Details

Stereochemistry ABSOLUTE
Molecular Formula C22H22N4O3
Molecular Weight 390.4351
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of IRSENONTRINE

SMILES

[H][C@@]1(CCOC1)N2N=CC3=C2C4=CC=C(C=C4NC3=O)C5=C(C)C(OC)=NC=C5C

InChI

InChIKey=CKJDCNZBABIEBZ-HNNXBMFYSA-N
InChI=1S/C22H22N4O3/c1-12-9-23-22(28-3)13(2)19(12)14-4-5-16-18(8-14)25-21(27)17-10-24-26(20(16)17)15-6-7-29-11-15/h4-5,8-10,15H,6-7,11H2,1-3H3,(H,25,27)/t15-/m0/s1

HIDE SMILES / InChI

Molecular Formula C22H22N4O3
Molecular Weight 390.4351
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 18:55:08 UTC 2023
Edited
by admin
on Sat Dec 16 18:55:08 UTC 2023
Record UNII
54QB00NNRB
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
IRSENONTRINE
INN   USAN  
Official Name English
E2027
Code English
4H-PYRAZOLO(4,3-C)QUINOLIN-4-ONE, 1,5-DIHYDRO-7-(2-METHOXY-3,5-DIMETHYL-4- PYRIDINYL)-1-((3S)-TETRAHYDRO-3-FURANYL)-
Systematic Name English
E-2027
Code English
ER-592221-00
Code English
irsenontrine [INN]
Common Name English
7-(2-METHOXY-3,5-DIMETHYLPYRIDIN-4-YL)-1-((3S)-TETRAHYDROFURAN-3-YL)-1,5-DIHYDRO-4H-PYRAZOLO(4,3-C)QUINOLIN-4-ONE
Systematic Name English
IRSENONTRINE [USAN]
Common Name English
Code System Code Type Description
INN
11606
Created by admin on Sat Dec 16 18:55:08 UTC 2023 , Edited by admin on Sat Dec 16 18:55:08 UTC 2023
PRIMARY
SMS_ID
300000039097
Created by admin on Sat Dec 16 18:55:08 UTC 2023 , Edited by admin on Sat Dec 16 18:55:08 UTC 2023
PRIMARY
PUBCHEM
136253996
Created by admin on Sat Dec 16 18:55:08 UTC 2023 , Edited by admin on Sat Dec 16 18:55:08 UTC 2023
PRIMARY
CAS
1429509-82-9
Created by admin on Sat Dec 16 18:55:08 UTC 2023 , Edited by admin on Sat Dec 16 18:55:08 UTC 2023
PRIMARY
USAN
HI-63
Created by admin on Sat Dec 16 18:55:08 UTC 2023 , Edited by admin on Sat Dec 16 18:55:08 UTC 2023
PRIMARY
NCI_THESAURUS
C179092
Created by admin on Sat Dec 16 18:55:08 UTC 2023 , Edited by admin on Sat Dec 16 18:55:08 UTC 2023
PRIMARY
FDA UNII
54QB00NNRB
Created by admin on Sat Dec 16 18:55:08 UTC 2023 , Edited by admin on Sat Dec 16 18:55:08 UTC 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY