Chemical data
- Formula
- C6H6S
- Molecular weight
- 110.18 g/mol
- IUPAC name
- thiepine
- SMILES
- C1=CC=CSC=C1
- InChIKey
- BISQTCXKVNCDDA-UHFFFAOYSA-N
- XLogP
- 2.2
- Polar surface area
- 25.3 Ų
- H-bond donors
- 0
- H-bond acceptors
- 1
- Formal charge
- 0
via PubChem
via PubChem
via Wikidata sitelinks · CC0
Discovered by embedding cosine similarity (sentence-transformers MiniLM, 384-dim).