Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | O=S(=O)(NN1C(=O)C(SC1=S)Cc2ccc(Cl)c(Cl)c2)c3sccc3 |
SMILES_CANONICAL | CACTVS | 3.341 | Clc1ccc(C[C@H]2SC(=S)N(N[S](=O)(=O)c3sccc3)C2=O)cc1Cl |
SMILES | CACTVS | 3.341 | Clc1ccc(C[CH]2SC(=S)N(N[S](=O)(=O)c3sccc3)C2=O)cc1Cl |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | c1cc(sc1)S(=O)(=O)NN2C(=O)[C@H](SC2=S)Cc3ccc(c(c3)Cl)Cl |
SMILES | OpenEye OEToolkits | 1.5.0 | c1cc(sc1)S(=O)(=O)NN2C(=O)C(SC2=S)Cc3ccc(c(c3)Cl)Cl |
InChI | InChI | 1.03 | InChI=1S/C14H10Cl2N2O3S4/c15-9-4-3-8(6-10(9)16)7-11-13(19)18(14(22)24-11)17-25(20,21)12-2-1-5-23-12/h1-6,11,17H,7H2/t11-/m1/s1 |
InChIKey | InChI | 1.03 | GAOOBYJHWAKZKU-LLVKDONJSA-N |