Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | Clc1cc(c(Cl)cc1)S(=O)(=O)Nc2nc3cc(OC)cc(c3o2)c4cccc(N)c4 |
SMILES_CANONICAL | CACTVS | 3.341 | COc1cc2nc(N[S](=O)(=O)c3cc(Cl)ccc3Cl)oc2c(c1)c4cccc(N)c4 |
SMILES | CACTVS | 3.341 | COc1cc2nc(N[S](=O)(=O)c3cc(Cl)ccc3Cl)oc2c(c1)c4cccc(N)c4 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | COc1cc(c2c(c1)nc(o2)NS(=O)(=O)c3cc(ccc3Cl)Cl)c4cccc(c4)N |
SMILES | OpenEye OEToolkits | 1.5.0 | COc1cc(c2c(c1)nc(o2)NS(=O)(=O)c3cc(ccc3Cl)Cl)c4cccc(c4)N |
InChI | InChI | 1.03 | InChI=1S/C20H15Cl2N3O4S/c1-28-14-9-15(11-3-2-4-13(23)7-11)19-17(10-14)24-20(29-19)25-30(26,27)18-8-12(21)5-6-16(18)22/h2-10H,23H2,1H3,(H,24,25) |
InChIKey | InChI | 1.03 | GAYYMURZGLJDCT-UHFFFAOYSA-N |