BL0
Summary
| Name: | 1-[5-(dimethylamino)-1,3,4-thiadiazol-2-yl]methanesulfonamide |
| Synonyms: | 2-N,N-Dimethylamino-1,3,4-thiadiazole-5-methanesulfonamide |
| Formula: | C5 H10 N4 O2 S2 |
| Formal charge: | 0 |
| Formula weight: | 222.288 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | 1-[5-(dimethylamino)-1,3,4-thiadiazol-2-yl]methanesulfonamide |
| OpenEye OEToolkits | 1.5.0 | (5-dimethylamino-1,3,4-thiadiazol-2-yl)methanesulfonamide |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=S(=O)(N)Cc1nnc(s1)N(C)C |
| SMILES_CANONICAL | CACTVS | 3.341 | CN(C)c1sc(C[S](N)(=O)=O)nn1 |
| SMILES | CACTVS | 3.341 | CN(C)c1sc(C[S](N)(=O)=O)nn1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CN(C)c1nnc(s1)CS(=O)(=O)N |
| SMILES | OpenEye OEToolkits | 1.5.0 | CN(C)c1nnc(s1)CS(=O)(=O)N |
| InChI | InChI | 1.03 | InChI=1S/C5H10N4O2S2/c1-9(2)5-8-7-4(12-5)3-13(6,10)11/h3H2,1-2H3,(H2,6,10,11) |
| InChIKey | InChI | 1.03 | HZGQWVQLUYIYQA-UHFFFAOYSA-N |
