QOG
Summary
| Name: | 5-{[(propan-2-yl)carbamoyl]amino}-1,3,4-thiadiazole-2-sulfonamide |
| Formula: | C6 H11 N5 O3 S2 |
| Formal charge: | 0 |
| Formula weight: | 265.313 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 5-{[(propan-2-yl)carbamoyl]amino}-1,3,4-thiadiazole-2-sulfonamide |
| OpenEye OEToolkits | 2.0.7 | 1-propan-2-yl-3-(5-sulfamoyl-1,3,4-thiadiazol-2-yl)urea |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | C(C)(C)NC(=O)Nc1sc(S(N)(=O)=O)nn1 |
| InChI | InChI | 1.03 | InChI=1S/C6H11N5O3S2/c1-3(2)8-4(12)9-5-10-11-6(15-5)16(7,13)14/h3H,1-2H3,(H2,7,13,14)(H2,8,9,10,12) |
| InChIKey | InChI | 1.03 | YLZWSQAIKQWBTO-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | CC(C)NC(=O)Nc1sc(nn1)[S](N)(=O)=O |
| SMILES | CACTVS | 3.385 | CC(C)NC(=O)Nc1sc(nn1)[S](N)(=O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | CC(C)NC(=O)Nc1nnc(s1)S(=O)(=O)N |
| SMILES | OpenEye OEToolkits | 2.0.7 | CC(C)NC(=O)Nc1nnc(s1)S(=O)(=O)N |
