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

Details

Stereochemistry ACHIRAL
Molecular Formula C17H17FN2O4S
Molecular Weight 364.391
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of APARARENONE

SMILES

CC1(C)OC2=CC(NS(C)(=O)=O)=CC=C2N(C1=O)C3=CC=C(F)C=C3

InChI

InChIKey=AZNHWXAFPBYFGH-UHFFFAOYSA-N
InChI=1S/C17H17FN2O4S/c1-17(2)16(21)20(13-7-4-11(18)5-8-13)14-9-6-12(10-15(14)24-17)19-25(3,22)23/h4-10,19H,1-3H3

HIDE SMILES / InChI

Molecular Formula C17H17FN2O4S
Molecular Weight 364.391
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 01:34:56 GMT 2023
Edited
by admin
on Sat Dec 16 01:34:56 GMT 2023
Record UNII
832663U2NB
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
APARARENONE
INN   WHO-DD  
INN  
Official Name English
Apararenone [WHO-DD]
Common Name English
MT-3995
Code English
N-(4-(4-FLUOROPHENYL)-2,2-DIMETHYL-3-OXO-3,4-DIHYDRO-2H-1,4-BENZOXAZIN-7-YL)METHANESULFONAMIDE
Systematic Name English
apararenone [INN]
Common Name English
METHANESULFONAMIDE, N-(4-(4-FLUOROPHENYL)-3,4-DIHYDRO-2,2-DIMETHYL-3-OXO-2H-1,4-BENZOXAZIN-7-YL)-
Systematic Name English
Code System Code Type Description
DRUG BANK
DB15024
Created by admin on Sat Dec 16 01:34:56 GMT 2023 , Edited by admin on Sat Dec 16 01:34:56 GMT 2023
PRIMARY
EPA CompTox
DTXSID401337181
Created by admin on Sat Dec 16 01:34:56 GMT 2023 , Edited by admin on Sat Dec 16 01:34:56 GMT 2023
PRIMARY
FDA UNII
832663U2NB
Created by admin on Sat Dec 16 01:34:56 GMT 2023 , Edited by admin on Sat Dec 16 01:34:56 GMT 2023
PRIMARY
NCI_THESAURUS
C171675
Created by admin on Sat Dec 16 01:34:56 GMT 2023 , Edited by admin on Sat Dec 16 01:34:56 GMT 2023
PRIMARY
SMS_ID
100000170807
Created by admin on Sat Dec 16 01:34:56 GMT 2023 , Edited by admin on Sat Dec 16 01:34:56 GMT 2023
PRIMARY
ChEMBL
CHEMBL3545392
Created by admin on Sat Dec 16 01:34:56 GMT 2023 , Edited by admin on Sat Dec 16 01:34:56 GMT 2023
PRIMARY
CAS
945966-46-1
Created by admin on Sat Dec 16 01:34:56 GMT 2023 , Edited by admin on Sat Dec 16 01:34:56 GMT 2023
PRIMARY
INN
10322
Created by admin on Sat Dec 16 01:34:56 GMT 2023 , Edited by admin on Sat Dec 16 01:34:56 GMT 2023
PRIMARY
EVMPD
SUB184950
Created by admin on Sat Dec 16 01:34:56 GMT 2023 , Edited by admin on Sat Dec 16 01:34:56 GMT 2023
PRIMARY
WIKIPEDIA
Apararenone
Created by admin on Sat Dec 16 01:34:56 GMT 2023 , Edited by admin on Sat Dec 16 01:34:56 GMT 2023
PRIMARY
PUBCHEM
24744336
Created by admin on Sat Dec 16 01:34:56 GMT 2023 , Edited by admin on Sat Dec 16 01:34:56 GMT 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
Related Record Type Details
ACTIVE MOIETY