Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=S(=O)(c1cc(c(cc1N)C(F)(F)F)S(=O)(=O)N)N |
SMILES_CANONICAL | CACTVS | 3.341 | Nc1cc(c(cc1[S](N)(=O)=O)[S](N)(=O)=O)C(F)(F)F |
SMILES | CACTVS | 3.341 | Nc1cc(c(cc1[S](N)(=O)=O)[S](N)(=O)=O)C(F)(F)F |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1c(c(cc(c1N)S(=O)(=O)N)S(=O)(=O)N)C(F)(F)F |
SMILES | OpenEye OEToolkits | 1.5.0 | c1c(c(cc(c1N)S(=O)(=O)N)S(=O)(=O)N)C(F)(F)F |
InChI | InChI | 1.03 | InChI=1S/C7H8F3N3O4S2/c8-7(9,10)3-1-4(11)6(19(13,16)17)2-5(3)18(12,14)15/h1-2H,11H2,(H2,12,14,15)(H2,13,16,17) |
InChIKey | InChI | 1.03 | KRVABEGPNKGLOT-UHFFFAOYSA-N |