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Details

Stereochemistry ACHIRAL
Molecular Formula C23H17N5O3
Molecular Weight 411.4128
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(3-(4-((1H-INDAZOL-5-YL)AMINO)QUINAZOLIN-2-YL)PHENOXY)ACETIC ACID

SMILES

OC(=O)COC1=CC=CC(=C1)C2=NC3=C(C=CC=C3)C(NC4=CC=C5NN=CC5=C4)=N2

InChI

InChIKey=UHUDLFMBGUWKOR-UHFFFAOYSA-N
InChI=1S/C23H17N5O3/c29-21(30)13-31-17-5-3-4-14(11-17)22-26-20-7-2-1-6-18(20)23(27-22)25-16-8-9-19-15(10-16)12-24-28-19/h1-12H,13H2,(H,24,28)(H,29,30)(H,25,26,27)

HIDE SMILES / InChI

Molecular Formula C23H17N5O3
Molecular Weight 411.4128
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 18:28:34 UTC 2023
Edited
by admin
on Sat Dec 16 18:28:34 UTC 2023
Record UNII
4SQ6Q2M5KV
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
2-(3-(4-((1H-INDAZOL-5-YL)AMINO)QUINAZOLIN-2-YL)PHENOXY)ACETIC ACID
Systematic Name English
ACETIC ACID, 2-(3-(4-(1H-INDAZOL-5-YLAMINO)-2-QUINAZOLINYL)PHENOXY)-
Systematic Name English
BELUMOSUDIL METABOLITE M2
Common Name English
Code System Code Type Description
CAS
911417-62-4
Created by admin on Sat Dec 16 18:28:34 UTC 2023 , Edited by admin on Sat Dec 16 18:28:34 UTC 2023
PRIMARY
FDA UNII
4SQ6Q2M5KV
Created by admin on Sat Dec 16 18:28:34 UTC 2023 , Edited by admin on Sat Dec 16 18:28:34 UTC 2023
PRIMARY
PUBCHEM
59361988
Created by admin on Sat Dec 16 18:28:34 UTC 2023 , Edited by admin on Sat Dec 16 18:28:34 UTC 2023
PRIMARY
EPA CompTox
DTXSID501168094
Created by admin on Sat Dec 16 18:28:34 UTC 2023 , Edited by admin on Sat Dec 16 18:28:34 UTC 2023
PRIMARY
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