U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C22H21FN2O.ClH
Molecular Weight 384.874
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of SARIZOTAN HYDROCHLORIDE

SMILES

Cl.FC1=CC=C(C=C1)C2=CN=CC(CNC[C@H]3CCC4=C(O3)C=CC=C4)=C2

InChI

InChIKey=QDLVYMYXOLGZOD-ZMBIFBSDSA-N
InChI=1S/C22H21FN2O.ClH/c23-20-8-5-17(6-9-20)19-11-16(12-24-14-19)13-25-15-21-10-7-18-3-1-2-4-22(18)26-21;/h1-6,8-9,11-12,14,21,25H,7,10,13,15H2;1H/t21-;/m1./s1

HIDE SMILES / InChI

Molecular Formula C22H21FN2O
Molecular Weight 348.4133
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

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

Approval Year

Substance Class Chemical
Created
by admin
on Fri Dec 15 17:20:49 UTC 2023
Edited
by admin
on Fri Dec 15 17:20:49 UTC 2023
Record UNII
5P71E6YO9H
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
SARIZOTAN HYDROCHLORIDE
USAN  
USAN  
Official Name English
EMD-128130
Code English
3-PYRIDINEMETHANAMINE, N-(((2R)-3,4-DIHYDRO-2H-1-BENZOPYRAN-2-YL)METHYL)-5-(4-FLUOROPHENYL)-, MONOHYDROCHLORIDE
Common Name English
(-)-N-(((2R)-3,4-DIHYDRO-2H-1-BENZOPYRAN-2-YL)METHYL)-5-(4-FLUOROPHENYL)PYRIDINE-3-YL)METHANAMINE MONOHYDROCHLORIDE
Common Name English
SARIZOTAN HYDROCHLORIDE [USAN]
Common Name English
SARIZOTAN HCL
Common Name English
EMD 128130
Code English
3-PYRIDINEMETHANAMINE, N-(((2R)-3,4-DIHYDRO-2H-1-BENZOPYRAN-2-YL)METHYL)-5-(4-FLUOROPHENYL)-, HYDROCHLORIDE (1:1)
Systematic Name English
Classification Tree Code System Code
NCI_THESAURUS C1509
Created by admin on Fri Dec 15 17:20:49 UTC 2023 , Edited by admin on Fri Dec 15 17:20:49 UTC 2023
EU-Orphan Drug EU/3/15/1531
Created by admin on Fri Dec 15 17:20:49 UTC 2023 , Edited by admin on Fri Dec 15 17:20:49 UTC 2023
Code System Code Type Description
MESH
C443959
Created by admin on Fri Dec 15 17:20:49 UTC 2023 , Edited by admin on Fri Dec 15 17:20:49 UTC 2023
PRIMARY
FDA UNII
5P71E6YO9H
Created by admin on Fri Dec 15 17:20:49 UTC 2023 , Edited by admin on Fri Dec 15 17:20:49 UTC 2023
PRIMARY
NCI_THESAURUS
C76654
Created by admin on Fri Dec 15 17:20:49 UTC 2023 , Edited by admin on Fri Dec 15 17:20:49 UTC 2023
PRIMARY
USAN
RR-123
Created by admin on Fri Dec 15 17:20:49 UTC 2023 , Edited by admin on Fri Dec 15 17:20:49 UTC 2023
PRIMARY
ChEMBL
CHEMBL220808
Created by admin on Fri Dec 15 17:20:49 UTC 2023 , Edited by admin on Fri Dec 15 17:20:49 UTC 2023
PRIMARY
SMS_ID
100000084888
Created by admin on Fri Dec 15 17:20:49 UTC 2023 , Edited by admin on Fri Dec 15 17:20:49 UTC 2023
PRIMARY
CAS
195068-07-6
Created by admin on Fri Dec 15 17:20:49 UTC 2023 , Edited by admin on Fri Dec 15 17:20:49 UTC 2023
PRIMARY
EPA CompTox
DTXSID60173163
Created by admin on Fri Dec 15 17:20:49 UTC 2023 , Edited by admin on Fri Dec 15 17:20:49 UTC 2023
PRIMARY
EVMPD
SUB21592
Created by admin on Fri Dec 15 17:20:49 UTC 2023 , Edited by admin on Fri Dec 15 17:20:49 UTC 2023
PRIMARY
PUBCHEM
6918387
Created by admin on Fri Dec 15 17:20:49 UTC 2023 , Edited by admin on Fri Dec 15 17:20:49 UTC 2023
PRIMARY
DRUG BANK
DBSALT002015
Created by admin on Fri Dec 15 17:20:49 UTC 2023 , Edited by admin on Fri Dec 15 17:20:49 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY