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Details

Stereochemistry ABSOLUTE
Molecular Formula C17H20ClN3O3.C6H6O3S
Molecular Weight 507.987
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ARAZASETRON BESYLATE

SMILES

OS(=O)(=O)C1=CC=CC=C1.CN2C(=O)COC3=C(C=C(Cl)C=C23)C(=O)N[C@H]4CN5CCC4CC5

InChI

InChIKey=GFVBDLIBPSGFDL-ZOWNYOTGSA-N
InChI=1S/C17H20ClN3O3.C6H6O3S/c1-20-14-7-11(18)6-12(16(14)24-9-15(20)22)17(23)19-13-8-21-4-2-10(13)3-5-21;7-10(8,9)6-4-2-1-3-5-6/h6-7,10,13H,2-5,8-9H2,1H3,(H,19,23);1-5H,(H,7,8,9)/t13-;/m0./s1

HIDE SMILES / InChI

Molecular Formula C6H6O3S
Molecular Weight 158.175
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C17H20ClN3O3
Molecular Weight 349.812
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 13:48:24 GMT 2023
Edited
by admin
on Sat Dec 16 13:48:24 GMT 2023
Record UNII
UXP39EQ477
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ARAZASETRON BESYLATE
Common Name English
2H-1,4-BENZOXAZINE-8-CARBOXAMIDE, N-(3R)-1-AZABICYCLO(2.2.2)OCT-3-YL-6-CHLORO-3,4-DIHYDRO-4-METHYL-3-OXO-, BENZENESULFONATE (1:1)
Systematic Name English
(R)-AZASETRON BESYLATE
Common Name English
R-AZASETRON BESYLATE
Common Name English
Classification Tree Code System Code
FDA ORPHAN DRUG 593417
Created by admin on Sat Dec 16 13:48:24 GMT 2023 , Edited by admin on Sat Dec 16 13:48:24 GMT 2023
EU-Orphan Drug EU/3/16/1785
Created by admin on Sat Dec 16 13:48:24 GMT 2023 , Edited by admin on Sat Dec 16 13:48:24 GMT 2023
Code System Code Type Description
SMS_ID
100000177227
Created by admin on Sat Dec 16 13:48:24 GMT 2023 , Edited by admin on Sat Dec 16 13:48:24 GMT 2023
PRIMARY
CAS
2025360-91-0
Created by admin on Sat Dec 16 13:48:24 GMT 2023 , Edited by admin on Sat Dec 16 13:48:24 GMT 2023
PRIMARY
NCI_THESAURUS
C198978
Created by admin on Sat Dec 16 13:48:24 GMT 2023 , Edited by admin on Sat Dec 16 13:48:24 GMT 2023
PRIMARY
PUBCHEM
131801108
Created by admin on Sat Dec 16 13:48:24 GMT 2023 , Edited by admin on Sat Dec 16 13:48:24 GMT 2023
PRIMARY
FDA UNII
UXP39EQ477
Created by admin on Sat Dec 16 13:48:24 GMT 2023 , Edited by admin on Sat Dec 16 13:48:24 GMT 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY