Q71
Summary
| Name: | 7-fluoro-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione |
| Formula: | C7 H5 F N2 O3 S |
| Formal charge: | 0 |
| Formula weight: | 216.19 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | 7-fluoro-1lambda~6~,2,4-benzothiadiazine-1,1,3(2H,4H)-trione |
| OpenEye OEToolkits | 2.0.7 | 7-fluoranyl-1,1-bis(oxidanylidene)-4~{H}-1$l^{6},2,4-benzothiadiazin-3-one |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | c1(F)cc2c(cc1)NC(NS2(=O)=O)=O |
| InChI | InChI | 1.03 | InChI=1S/C7H5FN2O3S/c8-4-1-2-5-6(3-4)14(12,13)10-7(11)9-5/h1-3H,(H2,9,10,11) |
| InChIKey | InChI | 1.03 | ITUAGWGFDMMEMY-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | Fc1ccc2NC(=O)N[S](=O)(=O)c2c1 |
| SMILES | CACTVS | 3.385 | Fc1ccc2NC(=O)N[S](=O)(=O)c2c1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1cc2c(cc1F)S(=O)(=O)NC(=O)N2 |
| SMILES | OpenEye OEToolkits | 2.0.7 | c1cc2c(cc1F)S(=O)(=O)NC(=O)N2 |
