Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=S(=O)(c1sc2ccccc2c1)Nc3nc4ccc(Cl)cc4s3 |
InChI | InChI | 1.03 | InChI=1S/C15H9ClN2O2S3/c16-10-5-6-11-13(8-10)22-15(17-11)18-23(19,20)14-7-9-3-1-2-4-12(9)21-14/h1-8H,(H,17,18) |
InChIKey | InChI | 1.03 | MZAVPBQCWWIYEQ-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Clc1ccc2nc(N[S](=O)(=O)c3sc4ccccc4c3)sc2c1 |
SMILES | CACTVS | 3.385 | Clc1ccc2nc(N[S](=O)(=O)c3sc4ccccc4c3)sc2c1 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1ccc2c(c1)cc(s2)S(=O)(=O)Nc3nc4ccc(cc4s3)Cl |
SMILES | OpenEye OEToolkits | 1.7.6 | c1ccc2c(c1)cc(s2)S(=O)(=O)Nc3nc4ccc(cc4s3)Cl |