Type | Program | Version | Descriptor |
SMILES | ACDLabs | 10.04 | Clc1cc(c(Cl)cc1)S(=O)(=O)Nc2nc3cc(OC)cc(c3o2)c4ccc(OC)nc4 |
SMILES_CANONICAL | CACTVS | 3.341 | COc1cc2nc(N[S](=O)(=O)c3cc(Cl)ccc3Cl)oc2c(c1)c4ccc(OC)nc4 |
SMILES | CACTVS | 3.341 | COc1cc2nc(N[S](=O)(=O)c3cc(Cl)ccc3Cl)oc2c(c1)c4ccc(OC)nc4 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | COc1ccc(cn1)c2cc(cc3c2oc(n3)NS(=O)(=O)c4cc(ccc4Cl)Cl)OC |
SMILES | OpenEye OEToolkits | 1.5.0 | COc1ccc(cn1)c2cc(cc3c2oc(n3)NS(=O)(=O)c4cc(ccc4Cl)Cl)OC |
InChI | InChI | 1.03 | InChI=1S/C20H15Cl2N3O5S/c1-28-13-8-14(11-3-6-18(29-2)23-10-11)19-16(9-13)24-20(30-19)25-31(26,27)17-7-12(21)4-5-15(17)22/h3-10H,1-2H3,(H,24,25) |
InChIKey | InChI | 1.03 | KOKQLKWXOFRTHE-UHFFFAOYSA-N |