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2D Structure
Also known as: 35941-71-0, 5-chloro-3-(2-(4-(2-hydroxyethyl)piperazin-1-yl)-2-oxoethyl)benzo[d]thiazol-2(3h)-one hydrochloride, Tiaramide hcl, Solantal, Nta-194, Tiaramide hydrochloride-r
Molecular Formula
C15H19Cl2N3O3S
Molecular Weight
392.3  g/mol
InChI Key
UKNGDQSYPNBJAO-UHFFFAOYSA-N
FDA UNII
ITY1616X9T

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
5-chloro-3-[2-[4-(2-hydroxyethyl)piperazin-1-yl]-2-oxoethyl]-1,3-benzothiazol-2-one;hydrochloride
2.1.2 InChI
InChI=1S/C15H18ClN3O3S.ClH/c16-11-1-2-13-12(9-11)19(15(22)23-13)10-14(21)18-5-3-17(4-6-18)7-8-20;/h1-2,9,20H,3-8,10H2;1H
2.1.3 InChI Key
UKNGDQSYPNBJAO-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1CN(CCN1CCO)C(=O)CN2C3=C(C=CC(=C3)Cl)SC2=O.Cl
2.2 Other Identifiers
2.2.1 UNII
ITY1616X9T
2.3 Synonyms
2.3.1 MeSH Synonyms

1. Fk 1160

2. Nta-194

3. Solantal

4. Tiaramide

5. Tiaramide Monohydrochloride

2.3.2 Depositor-Supplied Synonyms

1. 35941-71-0

2. 5-chloro-3-(2-(4-(2-hydroxyethyl)piperazin-1-yl)-2-oxoethyl)benzo[d]thiazol-2(3h)-one Hydrochloride

3. Tiaramide Hcl

4. Solantal

5. Nta-194

6. Tiaramide Hydrochloride-r

7. Usv 2592 Hcl

8. Fk 1160

9. Nsc-289337

10. Fk-1160

11. 4-[(5-chloro-2-oxo-2h-benzothiazol-3-yl)acetyl]piperazine-1-ethanol Monohydrochloride

12. Ity1616x9t

13. Rhc-2592

14. 35941-71-0 (hcl)

15. 4-((5-chloro-2-oxo-3-benzothiazolinyl)acetyl)-1-piperazineethanol Monohydrochloride

16. Thiaramide

17. Fk 1160; Nsc 289337; Nta 194; Rhc 2592

18. Ventaval Tabletten

19. 1-piperazineethanol, 4-((5-chloro-2-oxo-3(2h)-benzothiazolyl)acetyl)-, Monohydrochloride

20. Thiaramide [german]

21. Nsc289337

22. Unii-ity1616x9t

23. 4-((5-chloro-2-oxo-2h-benzothiazol-3-yl)acetyl)piperazine-1-ethanol Monohydrochloride

24. Nta 194

25. Solantal (tn)

26. Einecs 252-802-7

27. Tiaramide Hydrochloride [usan:jan]

28. Nta-194tiaramide

29. Nsc 289337

30. Dsstox_cid_28683

31. Dsstox_rid_82953

32. Nta-194 Hcl

33. Dsstox_gsid_48757

34. Schembl181916

35. Chembl538059

36. Dtxsid6048757

37. Chebi:32222

38. Tiaramide Hydrochloride [mi]

39. Tox21_113221

40. Bdbm50222213

41. Fk1160

42. Mfcd01702832

43. Tiaramide Hydrochloride [jan]

44. 1-piperazineethanol, Monohydrochloride

45. Tiaramide Hydrochloride [usan]

46. Akos024464353

47. Tiaramide Hydrochloride (jp17/usan)

48. Tiaramide Hydrochloride [mart.]

49. 2-benzothiazolinone, 5-chloro-3-(4-(2-hydroxyethyl)-1-piperazinyl)carbonylmethyl-, Hcl

50. 4-((5-chloro-2-oxo-3(2h)-benzothiazolyl)acetyl)-1-piperazineethanol Hydrochloride

51. 5-chloro-3-(4-(2-hydroxyethyl)-1-piperazinyl)carbonylmethyl-2-benzothiazolinone Hydrochloride

52. Tiaramide Hydrochloride [who-dd]

53. 5-chloro-3-[2-[4-(2-hydroxyethyl)piperazin-1-yl]-2-oxoethyl]-1,3-benzothiazol-2-one;hydrochloride

54. As-74709

55. Cas-35941-71-0

56. T3176

57. D01341

58. D92667

59. A874495

60. Q27280902

61. 1-piperazineethanol, 4-((5-chloro-2-oxo-3(2h)-benzothiazolyl)acetyl)-, Hydrochloride

62. 4-[(5-chloro-2-oxo-2h-benzothiazol-3-yl)acetyl]piperazine-1-ethanolmonohydrochloride

63. 4-[(5-chloro-2-oxo-3-benzothiazolinyl)acetyl]-1-piperazineethanol Hydrochloride

64. 2(3h)-benzothiazolone, 5-chloro-3-(2-(4-(2-hydroxyethyl)-1-piperazinyl)-2-oxoethyl)-, Hydrochloride (1:1)

65. 5-chloro-3-(2-(4-(2-hydroxyethyl)piperazin-1-yl)-2-oxoethyl)benzo[d]thiazol-2(3h)-onehydrochloride

66. 5-chloro-3-[[4-(2-hydroxyethyl)piperazin-1-yl]carbonylmethyl]-2-benzothiazolinone Hydrochloride

67. 5-chloro-3-{2-[4-(2-hydroxyethyl)piperazin-1-yl]-2-oxoethyl}-2,3-dihydro-1,3-benzothiazol-2-one Hydrochloride

2.4 Create Date
2005-06-24
3 Chemical and Physical Properties
Molecular Weight 392.3 g/mol
Molecular Formula C15H19Cl2N3O3S
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count4
Exact Mass391.0524180 g/mol
Monoisotopic Mass391.0524180 g/mol
Topological Polar Surface Area89.4 Ų
Heavy Atom Count24
Formal Charge0
Complexity459
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count2
4 Pharmacology and Biochemistry
4.1 MeSH Pharmacological Classification

Anti-Inflammatory Agents, Non-Steroidal

Anti-inflammatory agents that are non-steroidal in nature. In addition to anti-inflammatory actions, they have analgesic, antipyretic, and platelet-inhibitory actions. They act by blocking the synthesis of prostaglandins by inhibiting cyclooxygenase, which converts arachidonic acid to cyclic endoperoxides, precursors of prostaglandins. Inhibition of prostaglandin synthesis accounts for their analgesic, antipyretic, and platelet-inhibitory actions; other mechanisms may contribute to their anti-inflammatory effects. (See all compounds classified as Anti-Inflammatory Agents, Non-Steroidal.)


Bronchodilator Agents

Agents that cause an increase in the expansion of a bronchus or bronchial tubes. (See all compounds classified as Bronchodilator Agents.)