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Details

Stereochemistry ABSOLUTE
Molecular Formula C13H24N4O3S.C4H4O4
Molecular Weight 432.492
Optical Activity ( + )
Defined Stereocenters 1 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of TIMOLOL MALEATE, (R)-

SMILES

OC(=O)\C=C/C(O)=O.CC(C)(C)NC[C@@H](O)COC1=NSN=C1N2CCOCC2

InChI

InChIKey=WLRMANUAADYWEA-ASSQPYIHSA-N
InChI=1S/C13H24N4O3S.C4H4O4/c1-13(2,3)14-8-10(18)9-20-12-11(15-21-16-12)17-4-6-19-7-5-17;5-3(6)1-2-4(7)8/h10,14,18H,4-9H2,1-3H3;1-2H,(H,5,6)(H,7,8)/b;2-1-/t10-;/m1./s1

HIDE SMILES / InChI

Molecular Formula C4H4O4
Molecular Weight 116.0722
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 1
Optical Activity NONE

Molecular Formula C13H24N4O3S
Molecular Weight 316.42
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 09:05:09 UTC 2023
Edited
by admin
on Sat Dec 16 09:05:09 UTC 2023
Record UNII
78U14B243Y
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
TIMOLOL MALEATE, (R)-
Common Name English
(R)-(+)-3-MORPHOLINO-4-(3-TERT-BUTYLAMINO-2-HYDROXYPROPOXY)-1,2,5-THIADIAZOLE HYDROGEN MALEATE
Systematic Name English
(R)-TIMOLOL HYDROGEN MALEATE
Common Name English
J369.187J
Code English
2-PROPANOL, 1-(TERT-BUTYLAMINO)-3-((4-MORPHOLINO-1,2,5-THIADIAZOL-3-YL)OXY)-, (+)-, MALEATE (1:1) (SALT), (-)-
Common Name English
(2R)-1-((1,1-DIMETHYLETHYL)AMINO)-3-((4-(4-MORPHOLINYL)-1,2,5-THIADIAZOL-3-YL)OXY)-2-PROPANOL (2Z)-2-BUTENEDIOATE SALT
Systematic Name English
TIMOLOL MALEATE, (+)-
Common Name English
(+)-TIMOLOL MALEATE
Common Name English
(2R)-1-((2-METHYL-2-PROPANYL)AMINO)-3-((4-(4-MORPHOLINYL)-1,2,5-THIADIAZOL-3-YL)OXY)-2-PROPANOL (2Z)-2-BUTENEDIOATE (1:1)
Systematic Name English
Timolol maleate, r-enantiomer [WHO-DD]
Common Name English
(+)-3-(3-(TERT-BUTYLAMINO)-2-HYDROXYPROPOXY)-4-MORPHOLINO-1,2,5-THIADIAZOLE MALEATE
Systematic Name English
(Z)-BUT-2-ENEDIOIC ACID, (2R)-1-(TERT-BUTYLAMINO)-3-((4-MORPHOLIN-4-YL-1,2,5-THIADIAZOL-3-YL)OXY)PROPAN-2-OL
Systematic Name English
(R)-(+)-TIMOLOL MALEATE
Common Name English
(+)-3-(3-TERT-BUTYLAMINO-2-HYDROXYPROPOXY)-4-MORPHOLINO-1,2,5-THIADIAZOLE HYDROGEN MALEATE
Systematic Name English
TIMOLOL MALEATE, R-ENANTIOMER
WHO-DD  
Common Name English
TIMOLOL RELATED COMPOUND A [USP-RS]
Common Name English
D-TIMOLOL MALEATE
Common Name English
2-PROPANOL, 1-((1,1-DIMETHYLETHYL)AMINO)-3-((4-(4-MORPHOLINYL)-1,2,5-THIADIAZOL-3-YL)OXY)-, (2R)-, (2Z)-2-BUTENEDIOATE (1:1)
Systematic Name English
Code System Code Type Description
SMS_ID
100000084608
Created by admin on Sat Dec 16 09:05:09 UTC 2023 , Edited by admin on Sat Dec 16 09:05:09 UTC 2023
PRIMARY
CAS
26839-77-0
Created by admin on Sat Dec 16 09:05:09 UTC 2023 , Edited by admin on Sat Dec 16 09:05:09 UTC 2023
PRIMARY
PUBCHEM
5702122
Created by admin on Sat Dec 16 09:05:09 UTC 2023 , Edited by admin on Sat Dec 16 09:05:09 UTC 2023
PRIMARY
FDA UNII
78U14B243Y
Created by admin on Sat Dec 16 09:05:09 UTC 2023 , Edited by admin on Sat Dec 16 09:05:09 UTC 2023
PRIMARY
ECHA (EC/EINECS)
248-034-7
Created by admin on Sat Dec 16 09:05:09 UTC 2023 , Edited by admin on Sat Dec 16 09:05:09 UTC 2023
PRIMARY
RS_ITEM_NUM
1667381
Created by admin on Sat Dec 16 09:05:09 UTC 2023 , Edited by admin on Sat Dec 16 09:05:09 UTC 2023
PRIMARY
EVMPD
SUB04876MIG
Created by admin on Sat Dec 16 09:05:09 UTC 2023 , Edited by admin on Sat Dec 16 09:05:09 UTC 2023
PRIMARY
Related Record Type Details
PARENT -> SALT/SOLVATE
Related Record Type Details
ACTIVE MOIETY