| PDB CCD ID: | TRU |
| Number of entries in BioLiP: | 6 |
| Chemical formula: | C8 H8 Cl3 N3 O4 S2 |
| InChI: | InChI=1S/C8H8Cl3N3O4S2/c9-3-1-4-6(2-5(3)19(12,15)16)20(17,18)14-8(13-4)7(10)11/h1-2,7-8,13-14H,(H2,12,15,16)/t8-/m1/s1 |
| InChIKey: | LMJSLTNSBFUCMU-MRVPVSSYSA-N |
| SMILES: | | Software | SMILES |
|---|
| OpenEye OEToolkits 1.5.0 | c1c2c(cc(c1Cl)S(=O)(=O)N)S(=O)(=O)N[C@@H](N2)C(Cl)Cl | | CACTVS 3.341 | N[S](=O)(=O)c1cc2c(N[C@H](N[S]2(=O)=O)C(Cl)Cl)cc1Cl | | ACDLabs 10.04 | O=S(=O)(c1c(Cl)cc2c(c1)S(=O)(=O)NC(N2)C(Cl)Cl)N | | CACTVS 3.341 | N[S](=O)(=O)c1cc2c(N[CH](N[S]2(=O)=O)C(Cl)Cl)cc1Cl | | OpenEye OEToolkits 1.5.0 | c1c2c(cc(c1Cl)S(=O)(=O)N)S(=O)(=O)NC(N2)C(Cl)Cl |
|
| Name: | 6-CHLORO-3-(DICHLOROMETHYL)-3,4-DIHYDRO-2H-1,2,4-BENZOTHIADIAZINE-7-SULFONAMIDE 1,1-DIOXIDE |
| ChEMBL: | CHEMBL1231193 |
| DrugBank: | DB08645 |
| ZINC: | ZINC000000897236 |
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