4-(8-AMINO-3-(1-BUT-2-YNOYL-2,3-DIHYDROPYRROL-5-YL)IMIDAZO(1,5-A)PYRAZIN-1-YL)-N-(2-PYRIDYL)BENZAMIDE

Details

Stereochemistry	ACHIRAL
Molecular Formula	C26H21N7O2
Molecular Weight	463.4906
Optical Activity	NONE
Defined Stereocenters	0 / 0
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 4-(8-AMINO-3-(1-BUT-2-YNOYL-2,3-DIHYDROPYRROL-5-YL)IMIDAZO(1,5-A)PYRAZIN-1-YL)-N-(2-PYRIDYL)BENZAMIDE

Structure Search

SMILES

CC#CC(=O)N1CCC=C1C2=NC(=C3N2C=CN=C3N)C4=CC=C(C=C4)C(=O)NC5=NC=CC=C5

InChI

InChIKey=LWOMTMVTNVSWGT-UHFFFAOYSA-N

InChI=1S/C26H21N7O2/c1-2-6-21(34)32-15-5-7-19(32)25-31-22(23-24(27)29-14-16-33(23)25)17-9-11-18(12-10-17)26(35)30-20-8-3-4-13-28-20/h3-4,7-14,16H,5,15H2,1H3,(H2,27,29)(H,28,30,35)

HIDE SMILES / InChI

Approval Year

Name

Type

Language

4-(8-AMINO-3-(1-BUT-2-YNOYL-2,3-DIHYDROPYRROL-5-YL)IMIDAZO(1,5-A)PYRAZIN-1-YL)-N-(2-PYRIDYL)BENZAMIDE

Systematic Name

English

ACALABRUTINIB METABOLITE M25

Preferred Name

English

Code System Code Type Description

FDA UNII

SP9546VC4G

Created by admin on Wed Apr 02 00:19:22 GMT 2025 , Edited by admin on Wed Apr 02 00:19:22 GMT 2025

PRIMARY

PUBCHEM

156596923

Created by admin on Wed Apr 02 00:19:22 GMT 2025 , Edited by admin on Wed Apr 02 00:19:22 GMT 2025

PRIMARY

PARENT (METABOLITE)


					I42748ELQW

Acalabrutinib

SUBSTANCE RECORD


					SP9546VC4G

4-(8-AMINO-3-(1-BUT-2-YNOYL-2,3-DIHYDROPYRROL-5-YL)IMIDAZO(1,5-A)PYRAZIN-1-YL)-N-(2-PYRIDYL)BENZAMIDE