Butoconazole nitrate

CAS Registry Number®

64872-77-1

CAS Name

Butoconazole nitrate

Molecular Formula

C19H17Cl3N2S.HNO3

Cite this Page

Butoconazole nitrate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=64872-77-1 (retrieved 2024-11-21) (CAS RN: 64872-77-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    162-163 °C

Source(s)

  • (1) Drugs - Synonyms and Properties data were obtained from Ashgate Publishing Co. (US)

Other Names and Identifiers

InChI

InChI=1S/C19H17Cl3N2S.HNO3/c20-15-7-4-14(5-8-15)6-9-16(12-24-11-10-23-13-24)25-19-17(21)2-1-3-18(19)22;2-1(3)4/h1-5,7-8,10-11,13,16H,6,9,12H2;(H,2,3,4)

InChIKey

InChIKey=ZHPWRQIPPNZNML-UHFFFAOYSA-N

SMILES

C(SC1=C(Cl)C=CC=C1Cl)(CN2C=CN=C2)CCC3=CC=C(Cl)C=C3.N(=O)(=O)O

Canonical SMILES

O=N(=O)O.ClC1=CC=C(C=C1)CCC(SC=2C(Cl)=CC=CC2Cl)CN3C=NC=C3

Other Names for this Substance

  • 1H-Imidazole, 1-[4-(4-chlorophenyl)-2-[(2,6-dichlorophenyl)thio]butyl]-, nitrate (1:1)
  • 1H-Imidazole, 1-[4-(4-chlorophenyl)-2-[(2,6-dichlorophenyl)thio]butyl]-, (±)-, mononitrate
  • 1H-Imidazole, 1-[4-(4-chlorophenyl)-2-[(2,6-dichlorophenyl)thio]butyl]-, mononitrate
  • Butoconazole nitrate
  • (±)-Butoconazole nitrate

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Deleted or Replaced CAS Registry Numbers

67085-14-7, 1427453-81-3, 1855858-66-0

CAS INSIGHTSTM
Targeted protein degrader structure, illustration