Type | Program | Version | Descriptor |
SMILES | ACDLabs | 11.02 | FC(F)(F)c1ccc(c(Cl)c1)S(=O)(=O)Nc4ccc(Sc2nc3cc(Cl)ccc3s2)c(Cl)c4 |
SMILES_CANONICAL | CACTVS | 3.352 | FC(F)(F)c1ccc(c(Cl)c1)[S](=O)(=O)Nc2ccc(Sc3sc4ccc(Cl)cc4n3)c(Cl)c2 |
SMILES | CACTVS | 3.352 | FC(F)(F)c1ccc(c(Cl)c1)[S](=O)(=O)Nc2ccc(Sc3sc4ccc(Cl)cc4n3)c(Cl)c2 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | c1cc(c(cc1C(F)(F)F)Cl)S(=O)(=O)Nc2ccc(c(c2)Cl)Sc3nc4cc(ccc4s3)Cl |
SMILES | OpenEye OEToolkits | 1.7.0 | c1cc(c(cc1C(F)(F)F)Cl)S(=O)(=O)Nc2ccc(c(c2)Cl)Sc3nc4cc(ccc4s3)Cl |
InChI | InChI | 1.03 | InChI=1S/C20H10Cl3F3N2O2S3/c21-11-2-4-17-15(8-11)27-19(32-17)31-16-5-3-12(9-13(16)22)28-33(29,30)18-6-1-10(7-14(18)23)20(24,25)26/h1-9,28H |
InChIKey | InChI | 1.03 | BYUHFXVHEGWPSE-UHFFFAOYSA-N |