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Details

Stereochemistry RACEMIC
Molecular Formula C15H21N3O2S3
Molecular Weight 371.541
Optical Activity ( + / - )
Defined Stereocenters 0 / 1
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of AROTINOLOL

SMILES

CC(C)(C)NCC(O)CSC1=NC(=CS1)C2=CC=C(S2)C(N)=O

InChI

InChIKey=BHIAIPWSVYSKJS-UHFFFAOYSA-N
InChI=1S/C15H21N3O2S3/c1-15(2,3)17-6-9(19)7-21-14-18-10(8-22-14)11-4-5-12(23-11)13(16)20/h4-5,8-9,17,19H,6-7H2,1-3H3,(H2,16,20)

HIDE SMILES / InChI

Molecular Formula C15H21N3O2S3
Molecular Weight 371.541
Charge 0
Count
Stereochemistry RACEMIC
Additional Stereochemistry No
Defined Stereocenters 0 / 1
E/Z Centers 0
Optical Activity ( + / - )

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 16:30:24 UTC 2023
Edited
by admin
on Sat Dec 16 16:30:24 UTC 2023
Record UNII
394E3P3B99
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
AROTINOLOL
INN   MI   WHO-DD  
INN  
Official Name English
(±)-5-(2-((3-(TERT-BUTYLAMINO)-2-HYDROXYPROPYL)THIO)-4-THIAZOLYL)-2-THIOPHENECARBOXAMIDE
Systematic Name English
arotinolol [INN]
Common Name English
AROTINOLOL [MI]
Common Name English
NSC-317940
Code English
Arotinolol [WHO-DD]
Common Name English
Classification Tree Code System Code
NCI_THESAURUS C29576
Created by admin on Sat Dec 16 16:30:25 UTC 2023 , Edited by admin on Sat Dec 16 16:30:25 UTC 2023
Code System Code Type Description
PUBCHEM
2239
Created by admin on Sat Dec 16 16:30:25 UTC 2023 , Edited by admin on Sat Dec 16 16:30:25 UTC 2023
PRIMARY
CAS
68377-92-4
Created by admin on Sat Dec 16 16:30:25 UTC 2023 , Edited by admin on Sat Dec 16 16:30:25 UTC 2023
PRIMARY
DRUG CENTRAL
243
Created by admin on Sat Dec 16 16:30:25 UTC 2023 , Edited by admin on Sat Dec 16 16:30:25 UTC 2023
PRIMARY
INN
5215
Created by admin on Sat Dec 16 16:30:25 UTC 2023 , Edited by admin on Sat Dec 16 16:30:25 UTC 2023
PRIMARY
NCI_THESAURUS
C72609
Created by admin on Sat Dec 16 16:30:25 UTC 2023 , Edited by admin on Sat Dec 16 16:30:25 UTC 2023
PRIMARY
EVMPD
SUB05568MIG
Created by admin on Sat Dec 16 16:30:25 UTC 2023 , Edited by admin on Sat Dec 16 16:30:25 UTC 2023
PRIMARY
DRUG BANK
DB09204
Created by admin on Sat Dec 16 16:30:25 UTC 2023 , Edited by admin on Sat Dec 16 16:30:25 UTC 2023
PRIMARY
MESH
C024523
Created by admin on Sat Dec 16 16:30:25 UTC 2023 , Edited by admin on Sat Dec 16 16:30:25 UTC 2023
PRIMARY
FDA UNII
394E3P3B99
Created by admin on Sat Dec 16 16:30:25 UTC 2023 , Edited by admin on Sat Dec 16 16:30:25 UTC 2023
PRIMARY
MERCK INDEX
m2052
Created by admin on Sat Dec 16 16:30:25 UTC 2023 , Edited by admin on Sat Dec 16 16:30:25 UTC 2023
PRIMARY Merck Index
ChEMBL
CHEMBL93298
Created by admin on Sat Dec 16 16:30:25 UTC 2023 , Edited by admin on Sat Dec 16 16:30:25 UTC 2023
PRIMARY
NSC
317940
Created by admin on Sat Dec 16 16:30:25 UTC 2023 , Edited by admin on Sat Dec 16 16:30:25 UTC 2023
PRIMARY
SMS_ID
100000086621
Created by admin on Sat Dec 16 16:30:25 UTC 2023 , Edited by admin on Sat Dec 16 16:30:25 UTC 2023
PRIMARY
WIKIPEDIA
AROTINOLOL
Created by admin on Sat Dec 16 16:30:25 UTC 2023 , Edited by admin on Sat Dec 16 16:30:25 UTC 2023
PRIMARY
EPA CompTox
DTXSID3022619
Created by admin on Sat Dec 16 16:30:25 UTC 2023 , Edited by admin on Sat Dec 16 16:30:25 UTC 2023
PRIMARY
Related Record Type Details
ENANTIOMER -> RACEMATE
ENANTIOMER -> RACEMATE
TARGET -> AGONIST
SALT/SOLVATE -> PARENT
Related Record Type Details
ACTIVE MOIETY