Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | BrC=2S/C(=N\C(=O)NS(=O)(=O)c1cccc(Cl)c1)NC=2 |
SMILES_CANONICAL | CACTVS | 3.352 | Clc1cccc(c1)[S](=O)(=O)NC(=O)N=C2NC=C(Br)S2 |
SMILES | CACTVS | 3.352 | Clc1cccc(c1)[S](=O)(=O)NC(=O)N=C2NC=C(Br)S2 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.6.1 | c1cc(cc(c1)Cl)S(=O)(=O)NC(=O)/N=C\2/NC=C(S2)Br |
SMILES | OpenEye OEToolkits | 1.6.1 | c1cc(cc(c1)Cl)S(=O)(=O)NC(=O)N=C2NC=C(S2)Br |
InChI | InChI | 1.03 | InChI=1S/C10H7BrClN3O3S2/c11-8-5-13-10(19-8)14-9(16)15-20(17,18)7-3-1-2-6(12)4-7/h1-5H,(H2,13,14,15,16) |
InChIKey | InChI | 1.03 | VRHXEPNJEQXSSS-UHFFFAOYSA-N |