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2D Structure
Also known as: 73151-29-8, Lomexin, Falvin, Fenticonazole mononitrate, Fenticonazole (nitrate), Rec 15/1476
Molecular Formula
C24H21Cl2N3O4S
Molecular Weight
518.4  g/mol
InChI Key
FJNRUWDGCVDXLU-UHFFFAOYSA-N
FDA UNII
8V4JGC8YRF

1 2D Structure

2D Structure

2 Identification
2.1 Computed Descriptors
2.1.1 IUPAC Name
1-[2-(2,4-dichlorophenyl)-2-[(4-phenylsulfanylphenyl)methoxy]ethyl]imidazole;nitric acid
2.1.2 InChI
InChI=1S/C24H20Cl2N2OS.HNO3/c25-19-8-11-22(23(26)14-19)24(15-28-13-12-27-17-28)29-16-18-6-9-21(10-7-18)30-20-4-2-1-3-5-20;2-1(3)4/h1-14,17,24H,15-16H2;(H,2,3,4)
2.1.3 InChI Key
FJNRUWDGCVDXLU-UHFFFAOYSA-N
2.1.4 Canonical SMILES
C1=CC=C(C=C1)SC2=CC=C(C=C2)COC(CN3C=CN=C3)C4=C(C=C(C=C4)Cl)Cl.[N+](=O)(O)[O-]
2.2 Other Identifiers
2.2.1 UNII
8V4JGC8YRF
2.3 Synonyms
2.3.1 MeSH Synonyms

1. 1-(2,4-dichloro-beta-((p-(phenylthio)benzyl)oxy)phenethyl)imidazole

2. Fenizolan

3. Fenticonazole

4. Fenticonazole Mononitate

5. Laurimic

6. Lomexin

7. Micofulvin

8. Rec 15-1476

9. Terlomexin

2.3.2 Depositor-Supplied Synonyms

1. 73151-29-8

2. Lomexin

3. Falvin

4. Fenticonazole Mononitrate

5. Fenticonazole (nitrate)

6. Rec 15/1476

7. Fenticonazole Nitrate [usan]

8. Rec 15-1476

9. 8v4jgc8yrf

10. 1-[2-(2,4-dichlorophenyl)-2-[(4-phenylsulfanylphenyl)methoxy]ethyl]imidazole;nitric Acid

11. Chebi:83606

12. Alpha-(2,4-dichlorophenyl)-beta,n-imidazolylethyl-4-phenylthiobenzyl Ether Nitrate

13. (+-)-1-(2,4-dichloro-beta-((p-(phenylthio)benzyl)oxy)phenethyl)imidazole Mononitrate

14. 1-(2-(2,4-dichlorophenyl)-2-((4-(phenylthio)benzyl)oxy)ethyl)-1h-imidazole Nitrate

15. Fenticonazole Nitrate (usan)

16. Fenticonazole Nitrate 100 Microg/ml In Acetonitrile

17. Lomexin Nitrate

18. Einecs 277-302-6

19. Unii-8v4jgc8yrf

20. Gynoxin

21. Fenticonazolnitrat

22. Lomexin (tn)

23. Tx 15338

24. 1-[2-(2,4-dichlorophenyl)-2-[(4-phenylsulfanylphenyl)methoxy]ethyl]imidazole; Nitric Acid

25. Rec-151476b Free Base

26. Schembl362708

27. Chembl2107703

28. Dtxsid30993890

29. Rec-151476

30. Bcpp000232

31. Hms3655j11

32. Bcp26349

33. Hy-b0359

34. Ac-426

35. Mfcd00941391

36. S2031

37. Fenticonazole Mononitrate [mi]

38. Fenticonazole Nitrate [mart.]

39. Akos015855521

40. Fenticonazole Nitrate [who-dd]

41. Bcp9000681

42. Ccg-269839

43. 1-(2-(2,4-dichlorophenyl)-2-((4-(phenylthio)phenyl)methoxy)ethyl)-1h-imidazolium Nitrate

44. 1-(2-(2,4-dichlorophenyl)-2-((4-phenylsulfanylphenyl)methoxy)ethyl)imidazole Nitrate

45. Imidazole, 1-(2,4-dichloro-beta-(p-(phenylthio)benzyloxy)phenethyl)-, Nitrate

46. Rec-15/1476

47. 1h-imidazole, 1-(2-(2,4-dichlorophenyl)-2-((4-(phenylthio)phenyl)methoxy)ethyl)-, (+-)-, Mononitrate

48. As-18687

49. 2,2,3,3,4,5-hexachlorobiphenyl

50. Fenticonazole Nitrate [ep Monograph]

51. F1008

52. Ft-0630820

53. Ft-0654253

54. Sw219219-1

55. D02583

56. A837734

57. Q27157007

58. 1-(2-(2,4-dichlorophenyl)-2-(4-(phenylthio)benzyloxy)ethyl)-1h-imidazole Nitrate

59. 1-[2-(2,4-dichlorophenyl)-2-[[4-(phenylthio)phenyl]methoxy]ethyl]imidazole; Nitric Acid

60. (+/-)-1-(2,4-dichloro-.beta.-((p-(phenylthio)benzyl)oxy)phenethyl)imidazole Mononitrate

61. 1h-imidazole, 1-(2-(2,4-dichlorophenyl)-2-((4-(phenylthio)phenyl)methoxy)ethyl)-, (+/-)-, Mononitrate

62. Nitric Acid--1-[2-(2,4-dichlorophenyl)-2-{[4-(phenylsulfanyl)phenyl]methoxy}ethyl]-1h-imidazole (1/1)

63. Rac-1-[2-(2,4-dichlorophenyl)-2-{[4-(phenylsulfanyl)benzyl]oxy}ethyl]-1h-imidazole Nitrate

2.4 Create Date
2005-08-08
3 Chemical and Physical Properties
Molecular Weight 518.4 g/mol
Molecular Formula C24H21Cl2N3O4S
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count8
Exact Mass517.0629827 g/mol
Monoisotopic Mass517.0629827 g/mol
Topological Polar Surface Area118 Ų
Heavy Atom Count34
Formal Charge0
Complexity524
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently Bonded Unit Count2
4 Pharmacology and Biochemistry
4.1 MeSH Pharmacological Classification

Antifungal Agents

Substances that destroy fungi by suppressing their ability to grow or reproduce. They differ from FUNGICIDES, INDUSTRIAL because they defend against fungi present in human or animal tissues. (See all compounds classified as Antifungal Agents.)