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 ACHIRAL
Molecular Formula C23H26N6O3S
Molecular Weight 466.556
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ROGARATINIB

SMILES

COCC1=C(CN2CCNC(=O)C2)N3N=CN=C(N)C3=C1C4=CC5=C(S4)C(OC)=CC(C)=C5

InChI

InChIKey=HNLRRJSKGXOYNO-UHFFFAOYSA-N
InChI=1S/C23H26N6O3S/c1-13-6-14-8-18(33-22(14)17(7-13)32-3)20-15(11-31-2)16(9-28-5-4-25-19(30)10-28)29-21(20)23(24)26-12-27-29/h6-8,12H,4-5,9-11H2,1-3H3,(H,25,30)(H2,24,26,27)

HIDE SMILES / InChI

Molecular Formula C23H26N6O3S
Molecular Weight 466.556
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 Tue Apr 01 16:40:33 GMT 2025
Edited
by admin
on Tue Apr 01 16:40:33 GMT 2025
Record UNII
98BSN6N516
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ROGARATINIB
INN  
INN  
Official Name English
rogaratinib [INN]
Preferred Name English
2-PIPERAZINONE, 4-((4-AMINO-6-(METHOXYMETHYL)-5-(7-METHOXY-5-METHYLBENZO(B)THIEN-2-YL)PYRROLO(2,1-F)(1,2,4)TRIAZIN-7-YL)METHYL)-
Systematic Name English
4-((4-AMINO-6-(METHOXYMETHYL)-5-(7-METHOXY-5-METHYL-1-BENZOTHIOPHEN-2-YL)PYRROLO(2,1-F)(1,2,4)TRIAZIN-7-YL)METHYL)PIPERAZIN-2-ONE
Systematic Name English
Rogaratinib [WHO-DD]
Common Name English
BAY-1163877
Code English
Code System Code Type Description
CAS
1443530-05-9
Created by admin on Tue Apr 01 16:40:33 GMT 2025 , Edited by admin on Tue Apr 01 16:40:33 GMT 2025
PRIMARY
NCI_THESAURUS
C112205
Created by admin on Tue Apr 01 16:40:33 GMT 2025 , Edited by admin on Tue Apr 01 16:40:33 GMT 2025
PRIMARY
ChEMBL
CHEMBL3545361
Created by admin on Tue Apr 01 16:40:33 GMT 2025 , Edited by admin on Tue Apr 01 16:40:33 GMT 2025
PRIMARY
FDA UNII
98BSN6N516
Created by admin on Tue Apr 01 16:40:33 GMT 2025 , Edited by admin on Tue Apr 01 16:40:33 GMT 2025
PRIMARY
INN
10372
Created by admin on Tue Apr 01 16:40:33 GMT 2025 , Edited by admin on Tue Apr 01 16:40:33 GMT 2025
PRIMARY
PUBCHEM
71611869
Created by admin on Tue Apr 01 16:40:33 GMT 2025 , Edited by admin on Tue Apr 01 16:40:33 GMT 2025
PRIMARY
DRUG BANK
DB15078
Created by admin on Tue Apr 01 16:40:33 GMT 2025 , Edited by admin on Tue Apr 01 16:40:33 GMT 2025
PRIMARY
SMS_ID
100000174651
Created by admin on Tue Apr 01 16:40:33 GMT 2025 , Edited by admin on Tue Apr 01 16:40:33 GMT 2025
PRIMARY
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