Terminology Service for NFDI4Health
JSON

alprazolam

Go to external page http://purl.obolibrary.org/obo/CHEBI_2611

A member of the class of triazolobenzodiazepines that is 4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine carrying methyl, phenyl and chloro substituents at positions 1, 6 and 8 respectively. Alprazolam is only found in individuals that have taken this drug.

Term info

Label

alprazolam

Synonyms
  • 8-chloro-1-methyl-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine
  • Alprazolam
database cross reference
Subsets

3_STAR

IUPAC NAME
8-chloro-1-methyl-6-phenyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepine [ IUPAC ]

charge

0

formula

C17H13ClN4

has obo namespace

chebi_ontology

has related synonym

8-Chloro-1-methyl-6-phenyl-4H-s-triazolo(4,3-a)(1,4)benzodiazepine, Xanax

id

CHEBI:2611

inchi

InChI=1S/C17H13ClN4/c1-11-20-21-16-10-19-17(12-5-3-2-4-6-12)14-9-13(18)7-8-15(14)22(11)16/h2-9H,10H2,1H3

inchikey

VREFGVBLTWBCJP-UHFFFAOYSA-N

mass

308.76478

monoisotopicmass

308.08287

smiles

Cc1nnc2CN=C(c3ccccc3)c3cc(Cl)ccc3-n12