StructureMoaOncology · CNS · cardio-metabolic · ADC catalog

Drug · Migraine · triptan · Migraine · triptan · Sourced compound

Eletriptan structure · mechanism

PubChem CID 77993. Molecular formula C22H26N2O2S. Independently assigned structure; reviewed 2026-10-08. Family grouping is editorial and does not establish shared activity.

Molecular structure from independently sourced SMILES

Eletriptan 2D structure

Role
Drug
Mechanism class
Migraine · triptan
InChIKey
PWVXXGRKLHYWKM-LJQANCHMSA-N
Structure checked
2026-10-08
Molecular formula
C22H26N2O2S
Structure source
PubChem
PubChem CID
77993
InChI Key
PWVXXGRKLHYWKM-LJQANCHMSA-N

How similarity is calculated

SMILES

CN1CCC[C@@H]1CC2=CNC3=C2C=C(C=C3)CCS(=O)(=O)C4=CC=CC=C4

Tags

triptan

Related compounds

  • SumatriptanSimilarity · Tanimoto 0.36 · DrugSourced compound
  • RizatriptanSimilarity · Tanimoto 0.29 · DrugSourced compound
  • ZolmitriptanSimilarity · Tanimoto 0.35 · DrugSourced compound
  • NaratriptanSimilarity · Tanimoto 0.43 · DrugSourced compound

External IDs · BioMoa

PubChem CID 77993ChEMBLBioMoa · BioMoa에서 검색BioMoa · 프로그램 검색 · Migraine / CNSBioMoa bridgeOpen on the family mapFlowStructure tableCNS Deep AnalysisMechanism class

StructureMoa is a chemical-structure exploration tool. Structural similarity, clustering, and SAR relationships are intended for research exploration and do not establish shared potency, selectivity, safety, efficacy, or clinical performance.

Methodology

Editorial responsibility and corrections

Operated and edited by the independent StructureMoa project. Explanations use AI assistance; structural identity and similarity are checked against source records and calculation tests. Molecular data and clinical or regulatory evidence have separate review scopes.

Source structures
PubChem · CID / SMILES / InChIKey
Calculations and automated checks
RDKit · Morgan / SMARTS
Disclosed specialist review
No separate external specialist review is disclosed. Passing automated tests is not specialist review of clinical claims.

For a correction, include the page URL, molecule name or CID, the field in question and a supporting source. Corrections are checked against sources, and the affected editorial update date is changed when a correction is published. [email protected]