| 種別 | プログラム | バージョン | 表記 |
| SMILES | ACDLabs | 12.01 | C(=O)(NS(c1cc(c(CCOC)s1)C)(=O)=O)Nc2sc(cn2)Br |
| InChI | InChI | 1.03 | InChI=1S/C12H14BrN3O4S3/c1-7-5-10(21-8(7)3-4-20-2)23(18,19)16-11(17)15-12-14-6-9(13)22-12/h5-6H,3-4H2,1-2H3,(H2,14,15,16,17) |
| InChIKey | InChI | 1.03 | GYLXXAGXBDRUHI-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | COCCc1sc(cc1C)[S](=O)(=O)NC(=O)Nc2sc(Br)cn2 |
| SMILES | CACTVS | 3.385 | COCCc1sc(cc1C)[S](=O)(=O)NC(=O)Nc2sc(Br)cn2 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | Cc1cc(sc1CCOC)S(=O)(=O)NC(=O)Nc2ncc(s2)Br |
| SMILES | OpenEye OEToolkits | 2.0.6 | Cc1cc(sc1CCOC)S(=O)(=O)NC(=O)Nc2ncc(s2)Br |
