T03
Summary
| Name: | 3-[(4-fluorobenzyl)sulfanyl]-4H-1,2,4-triazole |
| Formula: | C9 H8 F N3 S |
| Formal charge: | 0 |
| Formula weight: | 209.243 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 1.6.1 | 3-[(4-fluorophenyl)methylsulfanyl]-4H-1,2,4-triazole |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES_CANONICAL | CACTVS | 3.352 | Fc1ccc(CSc2[nH]cnn2)cc1 |
| SMILES | CACTVS | 3.352 | Fc1ccc(CSc2[nH]cnn2)cc1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | c1cc(ccc1CSc2[nH]cnn2)F |
| SMILES | OpenEye OEToolkits | 1.7.0 | c1cc(ccc1CSc2[nH]cnn2)F |
| InChI | InChI | 1.03 | InChI=1S/C9H8FN3S/c10-8-3-1-7(2-4-8)5-14-9-11-6-12-13-9/h1-4,6H,5H2,(H,11,12,13) |
| InChIKey | InChI | 1.03 | XLRSDRUBTQOPEY-UHFFFAOYSA-N |
