U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ACHIRAL
Molecular Formula C26H25N3O3
Molecular Weight 427.495
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ORELABRUTINIB

SMILES

NC(=O)C1=CC=C(N=C1C2=CC=C(OC3=CC=CC=C3)C=C2)C4CCN(CC4)C(=O)C=C

InChI

InChIKey=MZPVEMOYADUARK-UHFFFAOYSA-N
InChI=1S/C26H25N3O3/c1-2-24(30)29-16-14-18(15-17-29)23-13-12-22(26(27)31)25(28-23)19-8-10-21(11-9-19)32-20-6-4-3-5-7-20/h2-13,18H,1,14-17H2,(H2,27,31)

HIDE SMILES / InChI

Molecular Formula C26H25N3O3
Molecular Weight 427.495
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 14:47:54 GMT 2023
Edited
by admin
on Sat Dec 16 14:47:54 GMT 2023
Record UNII
WJA5UO9E10
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ORELABRUTINIB
USAN   INN  
Official Name English
Orelabrutinib [WHO-DD]
Common Name English
INNOBRUKA
Brand Name English
ICP-022
Code English
ORELABRUTINIB [USAN]
Common Name English
orelabrutinib [INN]
Common Name English
3-PYRIDINECARBOXAMIDE, 6-(1-(1-OXO-2-PROPEN-1-YL)-4-PIPERIDINYL)-2-(4-PHENOXYPHENYL)-
Systematic Name English
6-(1-(1-OXO-2-PROPEN-1-YL)-4-PIPERIDINYL)-2-(4-PHENOXYPHENYL)-3-PYRIDINECARBOXAMIDE
Systematic Name English
ICP022
Code English
Classification Tree Code System Code
FDA ORPHAN DRUG 788920
Created by admin on Sat Dec 16 14:47:55 GMT 2023 , Edited by admin on Sat Dec 16 14:47:55 GMT 2023
Code System Code Type Description
CAS
1655504-04-3
Created by admin on Sat Dec 16 14:47:55 GMT 2023 , Edited by admin on Sat Dec 16 14:47:55 GMT 2023
PRIMARY
NCI_THESAURUS
C156173
Created by admin on Sat Dec 16 14:47:55 GMT 2023 , Edited by admin on Sat Dec 16 14:47:55 GMT 2023
PRIMARY
PUBCHEM
91667513
Created by admin on Sat Dec 16 14:47:55 GMT 2023 , Edited by admin on Sat Dec 16 14:47:55 GMT 2023
PRIMARY
FDA UNII
WJA5UO9E10
Created by admin on Sat Dec 16 14:47:55 GMT 2023 , Edited by admin on Sat Dec 16 14:47:55 GMT 2023
PRIMARY
INN
11190
Created by admin on Sat Dec 16 14:47:55 GMT 2023 , Edited by admin on Sat Dec 16 14:47:55 GMT 2023
PRIMARY
SMS_ID
300000023877
Created by admin on Sat Dec 16 14:47:55 GMT 2023 , Edited by admin on Sat Dec 16 14:47:55 GMT 2023
PRIMARY
USAN
JK-81
Created by admin on Sat Dec 16 14:47:55 GMT 2023 , Edited by admin on Sat Dec 16 14:47:55 GMT 2023
PRIMARY
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