| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | O=S(=O)(c1sc2c(c1)C(NCC)CN(CCOCC)S2(=O)=O)N |
| SMILES_CANONICAL | CACTVS | 3.341 | CCN[C@H]1CN(CCOCC)[S](=O)(=O)c2sc(cc12)[S](N)(=O)=O |
| SMILES | CACTVS | 3.341 | CCN[CH]1CN(CCOCC)[S](=O)(=O)c2sc(cc12)[S](N)(=O)=O |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | CCN[C@H]1C[N@](S(=O)(=O)c2c1cc(s2)S(=O)(=O)N)CCOCC |
| SMILES | OpenEye OEToolkits | 1.5.0 | CCNC1CN(S(=O)(=O)c2c1cc(s2)S(=O)(=O)N)CCOCC |
| InChI | InChI | 1.03 | InChI=1S/C12H21N3O5S3/c1-3-14-10-8-15(5-6-20-4-2)23(18,19)12-9(10)7-11(21-12)22(13,16)17/h7,10,14H,3-6,8H2,1-2H3,(H2,13,16,17)/t10-/m0/s1 |
| InChIKey | InChI | 1.03 | BHFKHYVXDQDFSR-JTQLQIEISA-N |
