Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=S(=O)(c1sc(cc1)S(=O)(=O)NCc2sccc2)N |
SMILES_CANONICAL | CACTVS | 3.341 | N[S](=O)(=O)c1sc(cc1)[S](=O)(=O)NCc2sccc2 |
SMILES | CACTVS | 3.341 | N[S](=O)(=O)c1sc(cc1)[S](=O)(=O)NCc2sccc2 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc(sc1)CNS(=O)(=O)c2ccc(s2)S(=O)(=O)N |
SMILES | OpenEye OEToolkits | 1.5.0 | c1cc(sc1)CNS(=O)(=O)c2ccc(s2)S(=O)(=O)N |
InChI | InChI | 1.03 | InChI=1S/C9H10N2O4S4/c10-18(12,13)8-3-4-9(17-8)19(14,15)11-6-7-2-1-5-16-7/h1-5,11H,6H2,(H2,10,12,13) |
InChIKey | InChI | 1.03 | STOTVDLYLKWVJB-UHFFFAOYSA-N |