Timolol

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Systematic / IUPAC Name: 1-(tert-Butylamino)-3-[(4-morpholin-4-yl-1,2,5-thiadiazol-3-yl)oxy]propan-2-ol

ID: Reference2114

Other Names: 1-(tert-Butylamino)-3-[(4-morpholino-1,2,5-thiadiazol-3-yl)oxy]-2-propanol;
Timololo;
Timacar depot;
(1)-1-(tert-Butylamino)-3-[(4-(morpholin-4-yl)-1,2,5-thiadiazol-3-yl)oxy]propan-2-ol

Formula: C13H24N4O3S

Class: Therapeutics/Prescription Drugs Sports Doping Drugs

Spectral Data

Timolol mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.

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Available MS Data

Used Instruments Q Exactive Plus Orbitrap
No. of Spectral Trees 2
No. of Spectra 112
Tandem Spectra MS1, MS2
Ionization Methods ESI
Analyzers FT
Last Modification 1/27/2015 1:49:27 PM
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Identificators

InChI InChI=1S/C13H24N4O3S/c1-13(2,3)14-8-10(18)9-20-12-11(15-21-16-12)17-4-6-19-7-5-17/h10,14,18H,4-9H2,1-3H3
InChI Key BLJRIMJGRPQVNF-UHFFFAOYSA-N
Canonical SMILES CC(C)(C)NCC(COC1=NSN=C1N2CCOCC2)O
CAS 26839758
Splash
Other Names 1-(tert-Butylamino)-3-[(4-morpholino-1,2,5-thiadiazol-3-yl)oxy]-2-propanol;
Timololo;
Timacar depot;
(1)-1-(tert-Butylamino)-3-[(4-(morpholin-4-yl)-1,2,5-thiadiazol-3-yl)oxy]propan-2-ol

In Other Databases

ChEMBL CHEMBL173706
ChEBI CHEBI:39465
ChemIDPlus 029023481; 047148572; 050929981; 057073559
Wikipedia Timolol
ChemSpider 5278
PubChem 5478
DrugBank DB00373