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Substance Name: 2,3-Dehydro ketoconazole
RN: 254912-63-5
UNII: 54OX2F5ST1
InChIKey: GHVFISLXKPKRQU-OZXSUGGESA-N

Molecular Formula

  • C26-H26-Cl2-N4-O4

Molecular Weight

  • 529.4214
 
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Names and Synonyms

Results Name

  • 2,3-Dehydro ketoconazole

Name of Substance

  • R-049223

Synonyms

  • (+/-)-1-Acetyl-4-(4-((2-(2,4-dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolan-4-yl)methoxy)phenyl)1,2,3,4-tetrahydropyrazine
  • 1-Acetyl-4-(4-(((2RS,4SR)-2-(2,4-dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolan-4-yl)methoxy)phenyl)1,2,3,4-tetrahydropyrazine
  • 2,3-Dehydro ketoconazole
  • Ethanone, 1-(4-(4-(((2R,4S)-2-(2,4-dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolan-4-yl)methoxy)phenyl)-3,4-dihydro-1(2H)-pyrazinyl)-, rel-
  • Ketoconazole impurity A [EP]
  • R-049223
  • UNII-54OX2F5ST1

Registry Numbers

CAS Registry Number

  • 254912-63-5

FDA UNII

  • 54OX2F5ST1

System Generated Number

  • 0254912635

Structure Descriptors

InChI

1S/C26H26Cl2N4O4/c1-19(33)31-10-12-32(13-11-31)21-3-5-22(6-4-21)34-15-23-16-35-26(36-23,17-30-9-8-29-18-30)24-7-2-20(27)14-25(24)28/h2-10,12,14,18,23H,11,13,15-17H2,1H3/t23-,26-/m0/s1

InChIKey

GHVFISLXKPKRQU-OZXSUGGESA-N

Smiles

CC(=O)N1CCN(C=C1)c2ccc(cc2)OC[C@H]3CO[C@](O3)(Cn4ccnc4)c5ccc(cc5Cl)Cl