Molecule record

8-chloro-6-(2-chlorophenyl)-1-methyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine

C17H12Cl2N4

343.22 g/mol

Loading structure

Molecular properties

Formula
C17H12Cl2N4
Molar mass
343.22 g·mol−1
Exact mass
342.0439 Da
13
PubChem CID
5556

Functional groups

Alkane / alkyl carbon
Aromatic ring
Aryl halide

Physical properties

No source-backed physical properties are curated for this molecule yet.

Common names and synonyms

  • 12-chloro-9-(2-chlorophenyl)-3-methyl-2,4,5,8-tetraazatricyclo(8.4.0.0^(2,6))tetradeca-1(10),3,5,8,11,13-hexaene
  • 1HM943223R
  • 249-307-3
  • 28911-01-5
  • 4H-(1,2,4)Triazolo(4,3-a)(1,4)benzodiazepine, 8-chloro-6-(2-chlorophenyl)-1-methyl-
  • 4H-s-Triazolo(4,3-a)(1,4)benzodiazepine, 8-chloro-6-(o-chlorophenyl)-1-methyl-
  • 8-Chloro-6-(o-chlorophenyl)-1-methyl-4H-s-triazolo(4,3-a)(1,4)benzodiazepine
  • Apo Triazo
Show all 24 synonyms
  • CHEBI:9674
  • Clorazolam
  • DTXCID4026763
  • DTXSID6046763
  • Gen Triazolam
  • Halcion
  • Kention
  • N05CD05
  • Novidorm
  • RefChem:58531
  • Songar
  • Triazolam civ
  • Triazolamum
  • U-33,030
  • U33,030
  • triazolam

Structure identifiers

Canonical SMILES
Cc1nnc2n1-c1ccc(Cl)cc1C(c1ccccc1Cl)=NC2
Isomeric SMILES
CC1=NN=C2N1C3=C(C=C(C=C3)Cl)C(=NC2)C4=CC=CC=C4Cl
InChI
InChI=1S/C17H12Cl2N4/c1-10-21-22-16-9-20-17(12-4-2-3-5-14(12)19)13-8-11(18)6-7-15(13)23(10)16/h2-8H,9H2,1H3
InChIKey
JOFWLTCLBGQGBO-UHFFFAOYSA-N
PubChem CID
5556

Spectroscopy

Tabs appear only for spectra stored with clear provenance.

Open library
No redistributable or simulated spectroscopy record is attached yet.

Simulated NMR

On-demand educational prediction for 8-chloro-6-(2-chlorophenyl)-1-methyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine; not experimental data.

Simulated EI mass spectrum

On-demand educational fragmentation for 8-chloro-6-(2-chlorophenyl)-1-methyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine; not experimental data.

Sources

Molecule identity

Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.

Open source record