PDB CCD ID: | HFZ |
Number of entries in BioLiP: | 5 |
Chemical formula: | C8 H8 F3 N3 O4 S2 |
InChI: | InChI=1S/C8H8F3N3O4S2/c9-8(10,11)4-1-5-7(2-6(4)19(12,15)16)20(17,18)14-3-13-5/h1-2,13-14H,3H2,(H2,12,15,16) |
InChIKey: | DMDGGSIALPNSEE-UHFFFAOYSA-N |
SMILES: | Software | SMILES |
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CACTVS 3.352 | N[S](=O)(=O)c1cc2c(NCN[S]2(=O)=O)cc1C(F)(F)F | OpenEye OEToolkits 1.7.0 | c1c(c(cc2c1NCNS2(=O)=O)S(=O)(=O)N)C(F)(F)F | ACDLabs 11.02 | FC(F)(F)c2c(cc1c(NCNS1(=O)=O)c2)S(=O)(=O)N |
|
Name: | 6-(trifluoromethyl)-3,4-dihydro-2H-1,2,4-benzothiadiazine-7-sulfonamide 1,1-dioxide |
ChEMBL: | CHEMBL1763 |
DrugBank: | DB00774 |
ZINC: | ZINC000000897225 |