LW1
Summary
| Name: | thiophene-2-carbaldehyde |
| Formula: | C5 H4 O S |
| Formal charge: | 0 |
| Formula weight: | 112.15 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | thiophene-2-carbaldehyde |
| OpenEye OEToolkits | 2.0.6 | thiophene-2-carbaldehyde |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | C(c1cccs1)=O |
| InChI | InChI | 1.03 | InChI=1S/C5H4OS/c6-4-5-2-1-3-7-5/h1-4H |
| InChIKey | InChI | 1.03 | CNUDBTRUORMMPA-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=Cc1sccc1 |
| SMILES | CACTVS | 3.385 | O=Cc1sccc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | c1cc(sc1)C=O |
| SMILES | OpenEye OEToolkits | 2.0.6 | c1cc(sc1)C=O |
