Molecular properties
- Formula
- C4H2N2S
- Molar mass
- 110.14 g·mol−1
- Exact mass
- 109.9939 Da
- 5
- PubChem CID
- 19428934
Molecule record
1,2-thiazole-3-carbonitrile
C4H2N2S
110.14 g/mol
Loading structure
Functional groups
Nitrile
Physical properties
No source-backed physical properties are curated for this molecule yet.
Common names and synonyms
- 1,2-Thiazole-3-carbonitrile - [T94270]
- 1452-17-1
- 3-Cyanoisothiazole
- 3-Isothiazolecarbonitrile
- 812-977-8
- AKOS016005439
- BAA45217
- CS-0214859
Show all 24 synonyms
- DB-063594
- DTXCID20549502
- DTXSID30598743
- EN300-199588
- GEO-04061
- ISOTHIAZOLE-3-CARBONITRILE
- Isothiazole-3-carbonitrile 97%
- Isothiazole-3-carbonitrile97%
- MFCD15529707
- PS-5052
- RefChem:412229
- SCHEMBL1816411
- SCHEMBL1995666
- SCHEMBL2046035
- SY065706
- cyano isothiazole
Structure identifiers
- Canonical SMILES
- N#Cc1ccsn1
- Isomeric SMILES
- C1=CSN=C1C#N
- InChI
- InChI=1S/C4H2N2S/c5-3-4-1-2-7-6-4/h1-2H
- InChIKey
- RKKGUHKROGFETL-UHFFFAOYSA-N
- PubChem CID
- 19428934
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 1,2-thiazole-3-carbonitrile; not experimental data.
Simulated EI mass spectrum
On-demand educational fragmentation for 1,2-thiazole-3-carbonitrile; not experimental data.
Sources
Molecule identity
Retrieved 8/20/2026. Reuse status is summarized by the badge; open the source for full details.