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Chemistry

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Also known as: 119006-77-8, Flutrimazol, Ur-4056, Flutrimazolum, 1-[(2-fluorophenyl)-(4-fluorophenyl)-phenylmethyl]imidazole, Micetal

Molecular Formula

C₂₂H₁₆F₂N₂

Molecular Weight

346.4 g/mol

InChI Key

QHMWCHQXCUNUAK-UHFFFAOYSA-N

FDA UNII

776S0UP252

1 2D Structure

Flutrimazole

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

1-[(2-fluorophenyl)-(4-fluorophenyl)-phenylmethyl]imidazole

2.1.2 InChI

InChI=1S/C22H16F2N2/c23-19-12-10-18(11-13-19)22(26-15-14-25-16-26,17-6-2-1-3-7-17)20-8-4-5-9-21(20)24/h1-16H

2.1.3 InChI Key

QHMWCHQXCUNUAK-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1=CC=C(C=C1)C(C2=CC=C(C=C2)F)(C3=CC=CC=C3F)N4C=CN=C4

2.2 Other Identifiers

2.2.1 UNII

776S0UP252

2.3 Synonyms

2.3.1 MeSH Synonyms

1. 1-((2-fluorophenyl)(4-fluorophenyl)phenylmethyl)-1h-imidazole

2. Cutimian

3. Flusporan

4. Funcenal

5. Micetal

6. Ur 4056

7. Ur-4056

2.3.2 Depositor-Supplied Synonyms

1. 119006-77-8

2. Flutrimazol

3. Ur-4056

4. Flutrimazolum

5. 1-[(2-fluorophenyl)-(4-fluorophenyl)-phenylmethyl]imidazole

6. Micetal

7. Flutrimazole [inn]

8. 1-[(2-fluorophenyl)(4-fluorophenyl)(phenyl)methyl]imidazole

9. 1-((2-fluorophenyl)(4-fluorophenyl)phenylmethyl)-1h-imidazole

10. 1-(o-fluoro-alpha-(p-fluorophenyl)-alpha-phenylbenzyl)imidazole

11. Chebi:82864

12. 1h-imidazole, 1-((2-fluorophenyl)(4-fluorophenyl)phenylmethyl)-

13. Flutrimazole (inn)

14. Mfcd00865591

15. 776s0up252

16. Flusporan

17. 1-[(2-fluorophenyl)(4-fluorophenyl)phenylmethyl]-1h-imidazole

18. 1h-imidazole, 1-[(2-fluorophenyl)(4-fluorophenyl)phenylmethyl]-

19. Flutrimazol [inn-spanish]

20. Flutrimazolum [inn-latin]

21. Flutrimazole [inn:ban]

22. Brn 5383184

23. Flutrimazolc

24. Cutiman

25. (flutrimazol)

26. Unii-776s0up252

27. Spectrum_001620

28. 1-[(2-fluorophenyl)-(4-fluorophenyl)phenylmethyl]-1h-imidazole

29. Spectrum2_001606

30. Spectrum3_001179

31. Spectrum4_000232

32. Spectrum5_001485

33. Flutrimazole [mi]

34. Bspbio_002797

35. Flutrimazole [mart.]

36. Kbiogr_000923

37. Kbioss_002100

38. Divk1c_000714

39. Divk1c_001036

40. Flutrimazole [who-dd]

41. Schembl154962

42. Spbio_001611

43. Chembl2107430

44. Hms502d16

45. Hms503o13

46. Kbio1_000714

47. Kbio1_001036

48. Kbio2_002100

49. Kbio2_004668

50. Kbio2_007236

51. Kbio3_002297

52. Dtxsid30869622

53. Ninds_000714

54. Ninds_001036

55. 1-(2,4'-difluorotrityl)imidazole

56. Flutrimazole [ep Monograph]

57. Bcp06210

58. Bdbm50436201

59. Ccg-39064

60. Akos015889487

61. Ac-8380

62. Db13425

63. Idi1_000714

64. Idi1_001036

65. Qtl1_000038

66. Am808133

67. Cs-11531

68. Sy024110

69. Db-041436

70. Hy-129060

71. Cs-0103421

72. Ft-0631093

73. D07193

74. F52533

75. 006f778

76. A804147

77. J-004048

78. Q5462984

79. 1-[(2-fluorophenyl)(4-fluorophenyl)(phenyl)methyl]imidazol

80. 1-((2-fluorophenyl)(4-fluorophenyl)(phenyl)methyl)-1h-imidazole

81. (s)-1-((2-fluorophenyl)(4-fluorophenyl)(phenyl)methyl)-1h-imidazole

82. 1-(o-fluoro-.alpha.-(p-fluorophenyl)-.alpha.-phenylbenzyl)imidazole

83. 1-[(2-fluorophenyl)(4-fluorophenyl)phenylmethyl]-1h-imidazole, Aldrichcpr

2.4 Create Date

2005-03-25

3 Chemical and Physical Properties

Molecular Formula	C₂₂H₁₆F₂N₂
Molecular Weight	346.4 g/mol
XLogP3	4.6
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	3
Rotatable Bond Count	4
Exact Mass	346.12815484 g/mol
Monoisotopic Mass	346.12815484 g/mol
Topological Polar Surface Area	17.8 Å²
Heavy Atom Count	26
Formal Charge	0
Complexity	445
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	1
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

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.)

4.2 ATC Code

D - Dermatologicals

D01 - Antifungals for dermatological use

D01A - Antifungals for topical use

D01AC - Imidazole and triazole derivatives

D01AC16 - Flutrimazole

G - Genito urinary system and sex hormones

G01 - Gynecological antiinfectives and antiseptics

G01A - Antiinfectives and antiseptics, excl. combinations with corticosteroids

G01AF - Imidazole derivatives

G01AF18 - Flutrimazole

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