2-Bromo-4-(2-chlorophenyl)-9-cyclohexyl-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepine

CAS Registry Number®

58765-21-2

CAS Name

2-Bromo-4-(2-chlorophenyl)-9-cyclohexyl-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepine

Molecular Formula

C20H18BrClN4S

Molecular Mass

461.81

Cite this Page

2-Bromo-4-(2-chlorophenyl)-9-cyclohexyl-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=58765-21-2 (retrieved 2025-01-28) (CAS RN: 58765-21-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    180-181 °C

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C20H18BrClN4S/c21-16-10-14-18(13-8-4-5-9-15(13)22)23-11-17-24-25-19(26(17)20(14)27-16)12-6-2-1-3-7-12/h4-5,8-10,12H,1-3,6-7,11H2

InChIKey

InChIKey=ZOSHXIXUCKESEG-UHFFFAOYSA-N

SMILES

BrC=1SC=2N3C(=NN=C3CN=C(C2C1)C4=C(Cl)C=CC=C4)C5CCCCC5

Canonical SMILES

ClC=1C=CC=CC1C2=NCC3=NN=C(N3C=4SC(Br)=CC24)C5CCCCC5

Other Names for this Substance

  • 6H-Thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepine, 2-bromo-4-(2-chlorophenyl)-9-cyclohexyl-
  • 2-Bromo-4-(2-chlorophenyl)-9-cyclohexyl-6H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepine
  • We 973
  • Ciclotizolam
  • We 973BS

Deleted or Replaced CAS Registry Numbers

71547-96-1