Molecular properties
- Formula
- C7H5NS2
- Molar mass
- 167.26 g·mol−1
- Exact mass
- 166.9863 Da
- 6
- PubChem CID
- 697993
Molecule record
3H-1,3-benzothiazole-2-thione
C7H5NS2
167.26 g/mol
Loading structure
Functional groups
Aromatic ring
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- 1,3-Benzothiazole-2-thiol
- 149-30-4
- 2(3H)-Benzothiazolethione
- 2-Benzothiazolethiol
- 2-MBT
- 2-Mercaptobenzothiazole
- Accelerator M
- Benzothiazole-2-thiol
Show all 24 synonyms
- Benzothiazolethiol
- Captax
- Dermacid
- Ekagom G
- Kaptax
- MERCAPTOBENZOTHIAZOLE
- Mebetizole
- Mebithizol
- Mertax
- Rokon
- Rotax
- Soxinol M
- Sulfadene
- Thiotax
- Vulkacit M
- Vulkacit Mercapto
Structure identifiers
- Canonical SMILES
- S=c1[nH]c2ccccc2s1
- Isomeric SMILES
- C1=CC=C2C(=C1)NC(=S)S2
- InChI
- InChI=1S/C7H5NS2/c9-7-8-5-3-1-2-4-6(5)10-7/h1-4H,(H,8,9)
- InChIKey
- YXIWHUQXZSMYRE-UHFFFAOYSA-N
- PubChem CID
- 697993
Spectroscopy
Tabs appear only for spectra stored with clear provenance.
No redistributable or simulated spectroscopy record is attached yet.
Simulated NMR
On-demand educational prediction for 3H-1,3-benzothiazole-2-thione; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 3H-1,3-benzothiazole-2-thione; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.