WA1
Summary
| Name: | 1-phenyl-3-(1,2,3-thiadiazol-5-yl)urea |
| Synonyms: | THIDIAZURON |
| Formula: | C9 H8 N4 O S |
| Formal charge: | 0 |
| Formula weight: | 220.251 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 1-phenyl-3-(1,2,3-thiadiazol-5-yl)urea |
| OpenEye OEToolkits | 1.7.2 | 1-phenyl-3-(1,2,3-thiadiazol-5-yl)urea |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | O=C(Nc1ccccc1)Nc2snnc2 |
| InChI | InChI | 1.03 | InChI=1S/C9H8N4OS/c14-9(12-8-6-10-13-15-8)11-7-4-2-1-3-5-7/h1-6H,(H2,11,12,14) |
| InChIKey | InChI | 1.03 | HFCYZXMHUIHAQI-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.370 | O=C(Nc1snnc1)Nc2ccccc2 |
| SMILES | CACTVS | 3.370 | O=C(Nc1snnc1)Nc2ccccc2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.2 | c1ccc(cc1)NC(=O)Nc2cnns2 |
| SMILES | OpenEye OEToolkits | 1.7.2 | c1ccc(cc1)NC(=O)Nc2cnns2 |
