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 C20H18F3N7O2.ClH
Molecular Weight 481.859
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ACRIZANIB HYDROCHLORIDE

SMILES

Cl.CNCC1=CC(OC2=CC3=C(C=C2)N(C=C3)C(=O)NC4=NN(C)C(=C4)C(F)(F)F)=NC=N1

InChI

InChIKey=LUWPLUJLLJFKEN-UHFFFAOYSA-N
InChI=1S/C20H18F3N7O2.ClH/c1-24-10-13-8-18(26-11-25-13)32-14-3-4-15-12(7-14)5-6-30(15)19(31)27-17-9-16(20(21,22)23)29(2)28-17;/h3-9,11,24H,10H2,1-2H3,(H,27,28,31);1H

HIDE SMILES / InChI

Molecular Formula ClH
Molecular Weight 36.461
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C20H18F3N7O2
Molecular Weight 445.3978
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 Mon Mar 31 19:21:40 GMT 2025
Edited
by admin
on Mon Mar 31 19:21:40 GMT 2025
Record UNII
96P75SW46E
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ACRIZANIB HYDROCHLORIDE
Common Name English
1H-INDOLE-1-CARBOXAMIDE, 5-((6-((METHYLAMINO)METHYL)-4-PYRIMIDINYL)OXY)-N-(1-METHYL-5-(TRIFLUOROMETHYL)-1H-PYRAZOL-3-YL)-, HYDROCHLORIDE (1:1)
Preferred Name English
Code System Code Type Description
PUBCHEM
117697811
Created by admin on Mon Mar 31 19:21:40 GMT 2025 , Edited by admin on Mon Mar 31 19:21:40 GMT 2025
PRIMARY
CAS
1637434-72-0
Created by admin on Mon Mar 31 19:21:40 GMT 2025 , Edited by admin on Mon Mar 31 19:21:40 GMT 2025
PRIMARY
FDA UNII
96P75SW46E
Created by admin on Mon Mar 31 19:21:40 GMT 2025 , Edited by admin on Mon Mar 31 19:21:40 GMT 2025
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY