U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS
This repository is under review for potential modification in compliance with Administration directives.

Details

Stereochemistry ABSOLUTE
Molecular Formula C25H26N6O2
Molecular Weight 442.5129
Optical Activity UNSPECIFIED
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of XILIERTINIB

SMILES

COC1=C(NC(=O)N2C[C@H]3CCN(C)[C@H]3C2)C=C4C(NC5=CC=CC(=C5)C#C)=NC=NC4=C1

InChI

InChIKey=FSXCKIBROURMFT-VGSWGCGISA-N
InChI=1S/C25H26N6O2/c1-4-16-6-5-7-18(10-16)28-24-19-11-21(23(33-3)12-20(19)26-15-27-24)29-25(32)31-13-17-8-9-30(2)22(17)14-31/h1,5-7,10-12,15,17,22H,8-9,13-14H2,2-3H3,(H,29,32)(H,26,27,28)/t17-,22+/m1/s1

HIDE SMILES / InChI

Molecular Formula C25H26N6O2
Molecular Weight 442.5129
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 00:24:47 GMT 2025
Edited
by admin
on Wed Apr 02 00:24:47 GMT 2025
Record UNII
6ZZ3B7NZ0B
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
THELIATINIB
Preferred Name English
XILIERTINIB
INN  
Official Name English
xiliertinib [INN]
Common Name English
HMPL-309
Code English
PYRROLO(3,4-B)PYRROLE-5(1H)-CARBOXAMIDE, N-(4-((3-ETHYNYLPHENYL)AMINO)-7-METHOXY-6-QUINAZOLINYL)HEXAHYDRO-1-METHYL-, (3AR,6AR)-
Systematic Name English
Xiliertinib [WHO-DD]
Common Name English
(3AR,6AR)-N-(4-((3-ETHYNYLPHENYL)AMINO)-7-METHOXY-6-QUINAZOLINYL)HEXAHYDRO-1-METHYLPYRROLO(3,4-B)PYRROLE-5(1H)-CARBOXAMIDE
Systematic Name English
Code System Code Type Description
SMS_ID
300000010821
Created by admin on Wed Apr 02 00:24:47 GMT 2025 , Edited by admin on Wed Apr 02 00:24:47 GMT 2025
PRIMARY
PUBCHEM
54759275
Created by admin on Wed Apr 02 00:24:47 GMT 2025 , Edited by admin on Wed Apr 02 00:24:47 GMT 2025
PRIMARY
INN
10897
Created by admin on Wed Apr 02 00:24:47 GMT 2025 , Edited by admin on Wed Apr 02 00:24:47 GMT 2025
PRIMARY
CAS
1353644-70-8
Created by admin on Wed Apr 02 00:24:47 GMT 2025 , Edited by admin on Wed Apr 02 00:24:47 GMT 2025
PRIMARY
NCI_THESAURUS
C162552
Created by admin on Wed Apr 02 00:24:47 GMT 2025 , Edited by admin on Wed Apr 02 00:24:47 GMT 2025
PRIMARY
FDA UNII
6ZZ3B7NZ0B
Created by admin on Wed Apr 02 00:24:47 GMT 2025 , Edited by admin on Wed Apr 02 00:24:47 GMT 2025
PRIMARY
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